2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine

C16H31N — CID 113483421

IUPAC2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine
SMILESCCC1CCC(CNC2CCCC2CC)CC1
InChIInChI=1S/C16H31N/c1-3-13-8-10-14(11-9-13)12-17-16-7-5-6-15(16)4-2/h13-17H,3-12H2,1-2H3
InChIKeySGTJCHDPCKAZGI-UHFFFAOYSA-N
MW237.43 g/mol
LogP4.37
Rot. Bonds5

About 2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine

2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine (PubChem CID 113483421) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is 2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine
PubChem CID113483421
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC Name2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine
SMILESCCC1CCC(CNC2CCCC2CC)CC1
InChIInChI=1S/C16H31N/c1-3-13-8-10-14(11-9-13)12-17-16-7-5-6-15(16)4-2/h13-17H,3-12H2,1-2H3
InChIKeySGTJCHDPCKAZGI-UHFFFAOYSA-N
XLogP4.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
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

4-[[(2-ethylcyclopentyl)amino]methyl]cyclohexan-1-ol
CID 106125475
N-[(1,1-dioxothian-4-yl)methyl]-2-ethylcyclohexan-1-amine
CID 75500184
4-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclohexan-1-amine
CID 55192738
N-[(4-ethylcyclohexyl)methyl]-2-piperidin-2-ylcyclopentan-1-amine
CID 79538663
2-ethyl-N-(3-methylbut-2-enyl)cyclopentan-1-amine
CID 103522734
[2-[(4-methylcyclohexyl)methylamino]cyclohexyl]methanol
CID 103872929
cis-(1R,2R)-2-ethyl-N-[[(2R)-oxolan-2-yl]methyl]cyclohexan-1-amine
CID 124710143
N-[(4-ethylcyclohexyl)methyl]-2-methyloxolan-3-amine
CID 115338207
1,3,6-triethyl-2-methylcyclononane
CID 58552764
3-[[(2-ethylcyclopentyl)amino]methyl]pentan-3-ol
CID 115714750
2-ethyl-N-prop-2-enylcyclohexan-1-amine
CID 62142413
1-(cyclopropylmethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol
CID 54955680

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine?
The IUPAC name of 2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine (CID 113483421) is 2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine?
The canonical SMILES for 2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine is CCC1CCC(CNC2CCCC2CC)CC1.
What is the InChIKey of 2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine?
The InChIKey is SGTJCHDPCKAZGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N/c1-3-13-8-10-14(11-9-13)12-17-16-7-5-6-15(16)4-2/h13-17H,3-12H2,1-2H3.
What are the key properties of 2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine?
2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine has a molecular weight of 237.43 g/mol, XLogP of 4.37, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 113483421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).