cis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine

C10H19N — CID 58274589

IUPACcis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine
SMILESC=C(C(C)C)[C@H]1CC[C@@H](N)C1
InChIInChI=1S/C10H19N/c1-7(2)8(3)9-4-5-10(11)6-9/h7,9-10H,3-6,11H2,1-2H3/t9-,10+/m0/s1
InChIKeyBZAUAXGONRLAIN-VHSXEESVSA-N
MW153.27 g/mol
LogP2.33
Rot. Bonds2

About cis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine

cis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine (PubChem CID 58274589) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is cis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine.

Molecular Properties

Compound Namecis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine
PubChem CID58274589
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Namecis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine
SMILESC=C(C(C)C)[C@H]1CC[C@@H](N)C1
InChIInChI=1S/C10H19N/c1-7(2)8(3)9-4-5-10(11)6-9/h7,9-10H,3-6,11H2,1-2H3/t9-,10+/m0/s1
InChIKeyBZAUAXGONRLAIN-VHSXEESVSA-N
XLogP2.33
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of cis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine?
The IUPAC name of cis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine (CID 58274589) is cis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine.
What is the SMILES notation for cis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine?
The canonical SMILES for cis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine is C=C(C(C)C)[C@H]1CC[C@@H](N)C1.
What is the InChIKey of cis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine?
The InChIKey is BZAUAXGONRLAIN-VHSXEESVSA-N. The full InChI is InChI=1S/C10H19N/c1-7(2)8(3)9-4-5-10(11)6-9/h7,9-10H,3-6,11H2,1-2H3/t9-,10+/m0/s1.
What are the key properties of cis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine?
cis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine has a molecular weight of 153.27 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,3S)-3-(3-methylbut-1-en-2-yl)cyclopentan-1-amine is sourced from PubChem (CID 58274589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).