N-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine

C15H29N — CID 81386660

IUPACN-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine
SMILESCCC1CCCCC1N[C@@H](C)C1CCCC1
InChIInChI=1S/C15H29N/c1-3-13-8-6-7-11-15(13)16-12(2)14-9-4-5-10-14/h12-16H,3-11H2,1-2H3/t12-,13?,15?/m0/s1
InChIKeyGGTUGOITTDMJLR-OPFPJEHXSA-N
MW223.40 g/mol
LogP4.12
Rot. Bonds4

About N-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine

N-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine (PubChem CID 81386660) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is N-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine
PubChem CID81386660
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC NameN-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine
SMILESCCC1CCCCC1N[C@@H](C)C1CCCC1
InChIInChI=1S/C15H29N/c1-3-13-8-6-7-11-15(13)16-12(2)14-9-4-5-10-14/h12-16H,3-11H2,1-2H3/t12-,13?,15?/m0/s1
InChIKeyGGTUGOITTDMJLR-OPFPJEHXSA-N
XLogP4.12
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[2-(1-cyclopentylethylamino)cyclopentyl]methanol
CID 115723803
2-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]cyclopentan-1-amine
CID 81384627
N-(1-cycloheptylethyl)-3-ethyl-2-methylcyclobutan-1-amine
CID 126604290
N-(1,1-difluoropropan-2-yl)-2-ethylcyclohexan-1-amine
CID 102868581
2-ethyl-N-(4-methylpentan-2-yl)cyclohexan-1-amine
CID 21355496
N-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine
CID 63995128
N-(1-cyclopentylethyl)-2-methylcyclohexan-1-amine
CID 62631533
2-[[(1R,2R)-2-ethylcyclohexyl]amino]propane-1,3-diol
CID 96980456
N-(1-cyclopentylethyl)-2-methylcyclopentan-1-amine
CID 63277954
N-[(1R)-1-cyclohexylethyl]-2-methylcyclohexan-1-amine
CID 81384477
trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol
CID 102733833
N-[(1S)-1-cyclohexylethyl]-2-methylcyclopentan-1-amine
CID 81387266

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine?
The IUPAC name of N-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine (CID 81386660) is N-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine.
What is the SMILES notation for N-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine?
The canonical SMILES for N-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine is CCC1CCCCC1N[C@@H](C)C1CCCC1.
What is the InChIKey of N-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine?
The InChIKey is GGTUGOITTDMJLR-OPFPJEHXSA-N. The full InChI is InChI=1S/C15H29N/c1-3-13-8-6-7-11-15(13)16-12(2)14-9-4-5-10-14/h12-16H,3-11H2,1-2H3/t12-,13?,15?/m0/s1.
What are the key properties of N-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine?
N-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine has a molecular weight of 223.40 g/mol, XLogP of 4.12, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-cyclopentylethyl]-2-ethylcyclohexan-1-amine is sourced from PubChem (CID 81386660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).