2-methyl-1-(4-propylcyclohexyl)pentan-1-amine

C15H31N — CID 107896549

IUPAC2-methyl-1-(4-propylcyclohexyl)pentan-1-amine
SMILESCCCC1CCC(C(N)C(C)CCC)CC1
InChIInChI=1S/C15H31N/c1-4-6-12(3)15(16)14-10-8-13(7-5-2)9-11-14/h12-15H,4-11,16H2,1-3H3
InChIKeyCNXNLJPGGLYNJN-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.36
Rot. Bonds6

About 2-methyl-1-(4-propylcyclohexyl)pentan-1-amine

2-methyl-1-(4-propylcyclohexyl)pentan-1-amine (PubChem CID 107896549) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is 2-methyl-1-(4-propylcyclohexyl)pentan-1-amine.

Molecular Properties

Compound Name2-methyl-1-(4-propylcyclohexyl)pentan-1-amine
PubChem CID107896549
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name2-methyl-1-(4-propylcyclohexyl)pentan-1-amine
SMILESCCCC1CCC(C(N)C(C)CCC)CC1
InChIInChI=1S/C15H31N/c1-4-6-12(3)15(16)14-10-8-13(7-5-2)9-11-14/h12-15H,4-11,16H2,1-3H3
InChIKeyCNXNLJPGGLYNJN-UHFFFAOYSA-N
XLogP4.36
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

cyclopropyl-(4-propylcyclohexyl)methanamine
CID 65424533
2-methyl-1-(thiolan-3-yl)pentan-1-amine
CID 107893917
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-methylpentan-1-amine
CID 107893950
1-(4-butylcyclohexyl)-2-methylpentan-1-ol
CID 114013662
2-cyclopentyl-1-(4-propylcyclohexyl)ethanamine
CID 65424909
N-methyl-1-(4-propylcyclohexyl)butan-1-amine
CID 65423384
3-methyl-1-(4-propylcyclohexyl)hexan-1-ol
CID 65424878
1-propan-2-yl-4-[2-(4-propan-2-ylcyclohexyl)ethyl]cyclohexane
CID 154060378
N,2-dimethyl-1-(4-propylcyclohexyl)butan-1-amine
CID 79445973
(3,5-dimethylcyclohexyl)-(4-propylcyclohexyl)methanamine
CID 65424912
1-[1-[(3R)-3,4-dimethylcyclopentyl]ethyl]-4-propylcyclohexane
CID 142573573
3-ethyl-1-(4-propylcyclohexyl)heptan-1-amine
CID 65423369

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(4-propylcyclohexyl)pentan-1-amine?
The IUPAC name of 2-methyl-1-(4-propylcyclohexyl)pentan-1-amine (CID 107896549) is 2-methyl-1-(4-propylcyclohexyl)pentan-1-amine.
What is the SMILES notation for 2-methyl-1-(4-propylcyclohexyl)pentan-1-amine?
The canonical SMILES for 2-methyl-1-(4-propylcyclohexyl)pentan-1-amine is CCCC1CCC(C(N)C(C)CCC)CC1.
What is the InChIKey of 2-methyl-1-(4-propylcyclohexyl)pentan-1-amine?
The InChIKey is CNXNLJPGGLYNJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-4-6-12(3)15(16)14-10-8-13(7-5-2)9-11-14/h12-15H,4-11,16H2,1-3H3.
What are the key properties of 2-methyl-1-(4-propylcyclohexyl)pentan-1-amine?
2-methyl-1-(4-propylcyclohexyl)pentan-1-amine has a molecular weight of 225.42 g/mol, XLogP of 4.36, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(4-propylcyclohexyl)pentan-1-amine is sourced from PubChem (CID 107896549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).