3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine

C16H31N — CID 83159871

IUPAC3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine
SMILESCC(C)NCC(C)(CC1CCCCC1)C1CC1
InChIInChI=1S/C16H31N/c1-13(2)17-12-16(3,15-9-10-15)11-14-7-5-4-6-8-14/h13-15,17H,4-12H2,1-3H3
InChIKeyPPZQQVSYVLOPDM-UHFFFAOYSA-N
MW237.43 g/mol
LogP4.37
Rot. Bonds6

About 3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine

3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine (PubChem CID 83159871) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is 3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine.

Molecular Properties

Compound Name3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine
PubChem CID83159871
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC Name3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine
SMILESCC(C)NCC(C)(CC1CCCCC1)C1CC1
InChIInChI=1S/C16H31N/c1-13(2)17-12-16(3,15-9-10-15)11-14-7-5-4-6-8-14/h13-15,17H,4-12H2,1-3H3
InChIKeyPPZQQVSYVLOPDM-UHFFFAOYSA-N
XLogP4.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.43
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(cyclohexylmethyl)-2,3-dimethyl-N-propan-2-ylbutan-1-amine
CID 83159223
2-cyclopropyl-2,4-dimethyl-N-propan-2-ylpentan-1-amine
CID 83159690
2-cyclopropyl-2,5,5-trimethyl-N-propan-2-ylhexan-1-amine
CID 83160149
2-(cyclopentylmethyl)-2-methyl-N-propan-2-ylbut-3-en-1-amine
CID 102641015
(3-bromo-2-cyclopropyl-2-methylpropyl)cyclohexane
CID 83150787
3-cyclohexyl-2-cyclopropyl-2-methylpropan-1-amine
CID 83149608
2-cyclopropyl-2-methyl-4-[(2-methylpropan-2-yl)oxy]-N-propan-2-ylbutan-1-amine
CID 112591624
2-cyclopropyl-2-methyl-3-(2-methylphenyl)-N-propan-2-ylpropan-1-amine
CID 83159965
2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine
CID 83159333
2-cyclopropyl-3-(2,6-dichlorophenyl)-2-methyl-N-propan-2-ylpropan-1-amine
CID 83159242
N-tert-butyl-2-cyclopropyl-2-methyl-3-(oxan-4-yl)propan-1-amine
CID 83160445
3-(cyclopentylmethoxy)-2,2-dimethyl-N-propan-2-ylpropan-1-amine
CID 79627805

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine?
The IUPAC name of 3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine (CID 83159871) is 3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine.
What is the SMILES notation for 3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine?
The canonical SMILES for 3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine is CC(C)NCC(C)(CC1CCCCC1)C1CC1.
What is the InChIKey of 3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine?
The InChIKey is PPZQQVSYVLOPDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N/c1-13(2)17-12-16(3,15-9-10-15)11-14-7-5-4-6-8-14/h13-15,17H,4-12H2,1-3H3.
What are the key properties of 3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine?
3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine has a molecular weight of 237.43 g/mol, XLogP of 4.37, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine is sourced from PubChem (CID 83159871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).