N,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide

C12H23NO — CID 12518171

IUPACN,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide
SMILESCC(C)C1CCC(C(=O)N(C)C)CC1
InChIInChI=1S/C12H23NO/c1-9(2)10-5-7-11(8-6-10)12(14)13(3)4/h9-11H,5-8H2,1-4H3
InChIKeySVWMZVILKUCNQK-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.54
Rot. Bonds2

About N,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide

N,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide (PubChem CID 12518171) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is N,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide
PubChem CID12518171
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC NameN,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide
SMILESCC(C)C1CCC(C(=O)N(C)C)CC1
InChIInChI=1S/C12H23NO/c1-9(2)10-5-7-11(8-6-10)12(14)13(3)4/h9-11H,5-8H2,1-4H3
InChIKeySVWMZVILKUCNQK-UHFFFAOYSA-N
XLogP2.54
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1R)-1-cyclopropylethyl]-N-methylcyclopropanecarboxamide
CID 52519617
N,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide
CID 71244330
N,N-dimethyl-5-propan-2-yloxane-2-carboxamide
CID 121459840
N,N-dimethyl-1-(2-methylpropyl)piperidine-4-carboxamide
CID 59603411
ethane;1-(4-propan-2-ylcyclohexyl)ethanone
CID 144871245
4-[1-cyclopropylethyl(methyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63782964
N,N-dimethyl-2-[(4-propan-2-ylcyclohexyl)amino]propanamide
CID 55106384
trans-(1R,3R)-1-N,1-N,3-N,3-N,2,2-hexamethyl-5-propan-2-ylcyclohexane-1,3-dicarboxamide
CID 131998414
N-[(1S)-1-cyclopropylethyl]-N-methylcyclopentanecarboxamide
CID 52522891
1,1-dimethyl-3-(4-propan-2-ylcyclohexyl)urea
CID 127484817
2-chloro-1-(4-propan-2-ylcyclohexyl)ethanone
CID 13192855
ethane;N-hydroxy-4-propan-2-ylcyclohexane-1-carboxamide
CID 167456902

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide?
The IUPAC name of N,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide (CID 12518171) is N,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide?
The canonical SMILES for N,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide is CC(C)C1CCC(C(=O)N(C)C)CC1.
What is the InChIKey of N,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide?
The InChIKey is SVWMZVILKUCNQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-9(2)10-5-7-11(8-6-10)12(14)13(3)4/h9-11H,5-8H2,1-4H3.
What are the key properties of N,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide?
N,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide has a molecular weight of 197.32 g/mol, XLogP of 2.54, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide is sourced from PubChem (CID 12518171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).