N-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide

C14H28N2O — CID 54880897

IUPACN-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide
SMILESCCC1CCC(CNC(=O)CNC(C)C)CC1
InChIInChI=1S/C14H28N2O/c1-4-12-5-7-13(8-6-12)9-16-14(17)10-15-11(2)3/h11-13,15H,4-10H2,1-3H3,(H,16,17)
InChIKeyAKFGQXDVKCBZRC-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.32
Rot. Bonds6

About N-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide

N-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide (PubChem CID 54880897) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide.

Molecular Properties

Compound NameN-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide
PubChem CID54880897
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide
SMILESCCC1CCC(CNC(=O)CNC(C)C)CC1
InChIInChI=1S/C14H28N2O/c1-4-12-5-7-13(8-6-12)9-16-14(17)10-15-11(2)3/h11-13,15H,4-10H2,1-3H3,(H,16,17)
InChIKeyAKFGQXDVKCBZRC-UHFFFAOYSA-N
XLogP2.32
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-ethylcyclohexyl)methyl]-4-(propan-2-ylamino)butanamide
CID 54880970
N-(cyclopropylmethyl)-2-(2-methylpentan-3-ylamino)acetamide
CID 61469190
2-(butan-2-ylamino)-N-(cyclohexylmethyl)acetamide
CID 60648633
N-[(4-ethylcyclohexyl)methyl]propan-2-amine
CID 60972109
N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide
CID 43567877
4-amino-N-[(4-ethylcyclohexyl)methyl]pentanamide;hydrochloride
CID 120561038
N-cyclopropyl-2-[[2-(cyclopropylmethylamino)-2-oxoethyl]amino]propanamide
CID 112623674
N-(cyclopropylmethyl)-2-(2-methylpropylamino)acetamide
CID 28566205
(2S)-2-amino-N-[(4-ethylcyclohexyl)methyl]propanamide
CID 61149083
2-chloro-N-[(4-ethylcyclohexyl)methyl]propanamide
CID 60971476
N-[(4-ethylcyclohexyl)methyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119743684
N-(cyclobutylmethyl)-2-(dicyclopentylmethylamino)acetamide
CID 75444208

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide?
The IUPAC name of N-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide (CID 54880897) is N-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide.
What is the SMILES notation for N-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide?
The canonical SMILES for N-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide is CCC1CCC(CNC(=O)CNC(C)C)CC1.
What is the InChIKey of N-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide?
The InChIKey is AKFGQXDVKCBZRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-4-12-5-7-13(8-6-12)9-16-14(17)10-15-11(2)3/h11-13,15H,4-10H2,1-3H3,(H,16,17).
What are the key properties of N-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide?
N-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide has a molecular weight of 240.39 g/mol, XLogP of 2.32, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide is sourced from PubChem (CID 54880897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).