3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide

C15H30N2O — CID 120650989

IUPAC3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide
SMILESCCN[C@H](C)CNC(=O)CC(C)C1CCCCC1
InChIInChI=1S/C15H30N2O/c1-4-16-13(3)11-17-15(18)10-12(2)14-8-6-5-7-9-14/h12-14,16H,4-11H2,1-3H3,(H,17,18)/t12?,13-/m1/s1
InChIKeyQMYWVZZOFUUYDC-ZGTCLIOFSA-N
MW254.42 g/mol
LogP2.71
Rot. Bonds7

About 3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide

3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide (PubChem CID 120650989) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide.

Molecular Properties

Compound Name3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide
PubChem CID120650989
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide
SMILESCCN[C@H](C)CNC(=O)CC(C)C1CCCCC1
InChIInChI=1S/C15H30N2O/c1-4-16-13(3)11-17-15(18)10-12(2)14-8-6-5-7-9-14/h12-14,16H,4-11H2,1-3H3,(H,17,18)/t12?,13-/m1/s1
InChIKeyQMYWVZZOFUUYDC-ZGTCLIOFSA-N
XLogP2.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide;hydrochloride
CID 120650988
3-cyclohexyl-N-[2-(methylamino)ethyl]butanamide;hydrochloride
CID 119503732
4-cyclohexyl-N-ethylpentan-2-amine
CID 64718542
N-[(1S)-1-cyclopentylethyl]-3-(ethylamino)butanamide
CID 81391367
N-(3-aminopropyl)-3-cyclohexylbutanamide;hydrochloride
CID 119408410
N-(2-methylbutyl)-3-piperidin-3-ylbutanamide
CID 81043770
2-cyclohexyloxy-N-[(2R)-2-(ethylamino)propyl]butanamide;hydrochloride
CID 120654844
N-(2,3-dimethylbutyl)-3-piperidin-4-ylbutanamide
CID 119796514
N-(cyclooctylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride
CID 119741883
N-(2-ethoxypropyl)-3-piperidin-3-ylbutanamide
CID 115739458
N-(2-cyclopentyl-2-hydroxyethyl)-3-methylbutanamide
CID 111425656
N-[(2R)-2-(ethylamino)propyl]bicyclo[3.1.0]hexane-6-carboxamide;hydrochloride
CID 120653330

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide?
The IUPAC name of 3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide (CID 120650989) is 3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide.
What is the SMILES notation for 3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide?
The canonical SMILES for 3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide is CCN[C@H](C)CNC(=O)CC(C)C1CCCCC1.
What is the InChIKey of 3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide?
The InChIKey is QMYWVZZOFUUYDC-ZGTCLIOFSA-N. The full InChI is InChI=1S/C15H30N2O/c1-4-16-13(3)11-17-15(18)10-12(2)14-8-6-5-7-9-14/h12-14,16H,4-11H2,1-3H3,(H,17,18)/t12?,13-/m1/s1.
What are the key properties of 3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide?
3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide has a molecular weight of 254.42 g/mol, XLogP of 2.71, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide is sourced from PubChem (CID 120650989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).