N-ethyl-1-propan-2-ylcyclohexane-1-carboxamide

C12H23NO — CID 3016622

IUPACN-ethyl-1-propan-2-ylcyclohexane-1-carboxamide
SMILESCCNC(=O)C1(C(C)C)CCCCC1
InChIInChI=1S/C12H23NO/c1-4-13-11(14)12(10(2)3)8-6-5-7-9-12/h10H,4-9H2,1-3H3,(H,13,14)
InChIKeyGQFRNZVKWUZJJY-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.73
Rot. Bonds3

About N-ethyl-1-propan-2-ylcyclohexane-1-carboxamide

N-ethyl-1-propan-2-ylcyclohexane-1-carboxamide (PubChem CID 3016622) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is N-ethyl-1-propan-2-ylcyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-1-propan-2-ylcyclohexane-1-carboxamide
PubChem CID3016622
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC NameN-ethyl-1-propan-2-ylcyclohexane-1-carboxamide
SMILESCCNC(=O)C1(C(C)C)CCCCC1
InChIInChI=1S/C12H23NO/c1-4-13-11(14)12(10(2)3)8-6-5-7-9-12/h10H,4-9H2,1-3H3,(H,13,14)
InChIKeyGQFRNZVKWUZJJY-UHFFFAOYSA-N
XLogP2.73
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-1-hydroxycyclopentane-1-carboxamide
CID 131085818
N-[8-(ethylamino)octyl]-1-propan-2-ylcyclopropane-1-carboxamide
CID 156820596
N-ethyl-2-methyl-1-propan-2-ylcyclohexane-1-carboxamide
CID 3016620
1-[1-(ethylamino)-3-methyl-1-oxobutan-2-yl]cyclopentane-1-carboxamide
CID 71026868
N-ethyl-1-methylcyclobutane-1-carboxamide
CID 131131875
4-[(1-propan-2-ylcyclopropanecarbonyl)amino]butanoic acid
CID 119352836
potassium;hydride;1-propan-2-ylcyclohexane-1-carboxamide
CID 173332130
1-amino-N-ethylcyclopropane-1-carboxamide;hydrochloride
CID 134692608
1-(2-aminoethyl)-N-ethylcyclopentane-1-carboxamide
CID 166106109
N,1-diethyl-2-methylcycloheptane-1-carboxamide
CID 20549202
ethyl 2-[(4-methyl-1-propan-2-ylcyclohexanecarbonyl)amino]acetate
CID 129202003
N-ethyl-1,2,2-trimethylcyclopentane-1-carboxamide
CID 135255073

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-propan-2-ylcyclohexane-1-carboxamide?
The IUPAC name of N-ethyl-1-propan-2-ylcyclohexane-1-carboxamide (CID 3016622) is N-ethyl-1-propan-2-ylcyclohexane-1-carboxamide.
What is the SMILES notation for N-ethyl-1-propan-2-ylcyclohexane-1-carboxamide?
The canonical SMILES for N-ethyl-1-propan-2-ylcyclohexane-1-carboxamide is CCNC(=O)C1(C(C)C)CCCCC1.
What is the InChIKey of N-ethyl-1-propan-2-ylcyclohexane-1-carboxamide?
The InChIKey is GQFRNZVKWUZJJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-4-13-11(14)12(10(2)3)8-6-5-7-9-12/h10H,4-9H2,1-3H3,(H,13,14).
What are the key properties of N-ethyl-1-propan-2-ylcyclohexane-1-carboxamide?
N-ethyl-1-propan-2-ylcyclohexane-1-carboxamide has a molecular weight of 197.32 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-propan-2-ylcyclohexane-1-carboxamide is sourced from PubChem (CID 3016622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).