cis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine

C134H275N9 — CID 162126164

IUPACcis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine
SMILESCC(C)C1CC(N)C1.CC(C)C1CCC(N)C1.CC(C)[C@@H]1CC[C@@H](N)C1.CC(C)[C@@H]1CC[C@H](N)C1.CC(C)[C@H]1CC[C@@H](N)C1.CC(C)[C@H]1CC[C@H](N)C1.CC1CC(C(C)C)C1.CC1CC(C(C)C)C1.CC1CC2(C1)CC(C(C)C)C2.CC1CCC(C(C)C)CC1.CC1CCC(C(C)C)CC1.CC1CCC(C(C)C)CC1.CNC1CCC(C(C)C)CC1.CNC1CCC(C(C)C)CC1.CNC1CCC(C(C)C)CC1
InChIInChI=1S/C11H20.3C10H21N.3C10H20.5C8H17N.2C8H16.C7H15N/c1-8(2)10-6-11(7-10)4-9(3)5-11;3*1-8(2)9-4-6-10(11-3)7-5-9;3*1-8(2)10-6-4-9(3)5-7-10;5*1-6(2)7-3-4-8(9)5-7;2*1-6(2)8-4-7(3)5-8;1-5(2)6-3-7(8)4-6/h8-10H,4-7H2,1-3H3;3*8-11H,4-7H2,1-3H3;3*8-10H,4-7H2,1-3H3;5*6-8H,3-5,9H2,1-2H3;2*6-8H,4-5H2,1-3H3;5-7H,3-4,8H2,1-2H3/t;;;;;;;2*7-,8+;2*7-,8-;;;;/m.......1010..../s1
InChIKeyZIBCORZPYYNYQO-ICKJGNFWSA-N
MW2012.74 g/mol
LogP36.74
Rot. Bonds18

About cis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine

cis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine (PubChem CID 162126164) has the molecular formula C134H275N9 and a molecular weight of 2012.74 g/mol. Its IUPAC name is cis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine.

Molecular Properties

Compound Namecis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine
PubChem CID162126164
Molecular FormulaC134H275N9
Molecular Weight2012.74 g/mol
Exact Mass2011.18
IUPAC Namecis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine
SMILESCC(C)C1CC(N)C1.CC(C)C1CCC(N)C1.CC(C)[C@@H]1CC[C@@H](N)C1.CC(C)[C@@H]1CC[C@H](N)C1.CC(C)[C@H]1CC[C@@H](N)C1.CC(C)[C@H]1CC[C@H](N)C1.CC1CC(C(C)C)C1.CC1CC(C(C)C)C1.CC1CC2(C1)CC(C(C)C)C2.CC1CCC(C(C)C)CC1.CC1CCC(C(C)C)CC1.CC1CCC(C(C)C)CC1.CNC1CCC(C(C)C)CC1.CNC1CCC(C(C)C)CC1.CNC1CCC(C(C)C)CC1
InChIInChI=1S/C11H20.3C10H21N.3C10H20.5C8H17N.2C8H16.C7H15N/c1-8(2)10-6-11(7-10)4-9(3)5-11;3*1-8(2)9-4-6-10(11-3)7-5-9;3*1-8(2)10-6-4-9(3)5-7-10;5*1-6(2)7-3-4-8(9)5-7;2*1-6(2)8-4-7(3)5-8;1-5(2)6-3-7(8)4-6/h8-10H,4-7H2,1-3H3;3*8-11H,4-7H2,1-3H3;3*8-10H,4-7H2,1-3H3;5*6-8H,3-5,9H2,1-2H3;2*6-8H,4-5H2,1-3H3;5-7H,3-4,8H2,1-2H3/t;;;;;;;2*7-,8+;2*7-,8-;;;;/m.......1010..../s1
InChIKeyZIBCORZPYYNYQO-ICKJGNFWSA-N
XLogP36.74
TPSA192.21 Ų
H-Bond Donors9
H-Bond Acceptors9
Rotatable Bonds18
Heavy Atoms143
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002012.74
LogP ≤ 536.74
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 109

Analyze cis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of cis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine?
The IUPAC name of cis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine (CID 162126164) is cis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine.
What is the SMILES notation for cis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine?
The canonical SMILES for cis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine is CC(C)C1CC(N)C1.CC(C)C1CCC(N)C1.CC(C)[C@@H]1CC[C@@H](N)C1.CC(C)[C@@H]1CC[C@H](N)C1.CC(C)[C@H]1CC[C@@H](N)C1.CC(C)[C@H]1CC[C@H](N)C1.CC1CC(C(C)C)C1.CC1CC(C(C)C)C1.CC1CC2(C1)CC(C(C)C)C2.CC1CCC(C(C)C)CC1.CC1CCC(C(C)C)CC1.CC1CCC(C(C)C)CC1.CNC1CCC(C(C)C)CC1.CNC1CCC(C(C)C)CC1.CNC1CCC(C(C)C)CC1.
What is the InChIKey of cis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine?
The InChIKey is ZIBCORZPYYNYQO-ICKJGNFWSA-N. The full InChI is InChI=1S/C11H20.3C10H21N.3C10H20.5C8H17N.2C8H16.C7H15N/c1-8(2)10-6-11(7-10)4-9(3)5-11;3*1-8(2)9-4-6-10(11-3)7-5-9;3*1-8(2)10-6-4-9(3)5-7-10;5*1-6(2)7-3-4-8(9)5-7;2*1-6(2)8-4-7(3)5-8;1-5(2)6-3-7(8)4-6/h8-10H,4-7H2,1-3H3;3*8-11H,4-7H2,1-3H3;3*8-10H,4-7H2,1-3H3;5*6-8H,3-5,9H2,1-2H3;2*6-8H,4-5H2,1-3H3;5-7H,3-4,8H2,1-2H3/t;;;;;;;2*7-,8+;2*7-,8-;;;;/m.......1010..../s1.
What are the key properties of cis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine?
cis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine has a molecular weight of 2012.74 g/mol, XLogP of 36.74, 18 rotatable bonds, 9 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,3R)-3-propan-2-ylcyclopentan-1-amine;cis-(1R,3S)-3-propan-2-ylcyclopentan-1-amine;bis(1-methyl-3-propan-2-ylcyclobutane);tris(N-methyl-4-propan-2-ylcyclohexan-1-amine);tris(1-methyl-4-propan-2-ylcyclohexane);6-methyl-2-propan-2-ylspiro[3.3]heptane;3-propan-2-ylcyclobutan-1-amine;3-propan-2-ylcyclopentan-1-amine;trans-(1R,3R)-3-propan-2-ylcyclopentan-1-amine;trans-(1S,3S)-3-propan-2-ylcyclopentan-1-amine is sourced from PubChem (CID 162126164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).