N-cyclohexyl-N,2-dimethylbutanamide

C12H23NO — CID 51112447

IUPACN-cyclohexyl-N,2-dimethylbutanamide
SMILESCCC(C)C(=O)N(C)C1CCCCC1
InChIInChI=1S/C12H23NO/c1-4-10(2)12(14)13(3)11-8-6-5-7-9-11/h10-11H,4-9H2,1-3H3
InChIKeyHZBIBTFINCACFH-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.82
Rot. Bonds3

About N-cyclohexyl-N,2-dimethylbutanamide

N-cyclohexyl-N,2-dimethylbutanamide (PubChem CID 51112447) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is N-cyclohexyl-N,2-dimethylbutanamide.

Molecular Properties

Compound NameN-cyclohexyl-N,2-dimethylbutanamide
PubChem CID51112447
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC NameN-cyclohexyl-N,2-dimethylbutanamide
SMILESCCC(C)C(=O)N(C)C1CCCCC1
InChIInChI=1S/C12H23NO/c1-4-10(2)12(14)13(3)11-8-6-5-7-9-11/h10-11H,4-9H2,1-3H3
InChIKeyHZBIBTFINCACFH-UHFFFAOYSA-N
XLogP2.82
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-cyclohexyl-3-methylbutanamide
CID 233660
N,N-di-i-propyl-2-ethylhexanamide
CID 559438
Acetamide, N-cyclohexyl-N-methyl-
CID 243970
Cyclohexanecarboxamide, N,N-bis(1-methylethyl)-
CID 4340777
Valeramide, N,N-diisopropyl-2-propyl-
CID 200759
N-cyclohexyl-N-ethyl-3-methylbutanamide
CID 670174
N-Cyclohexyl-N-ethylacetamide
CID 558465
N,N-Dicyclohexyl-3-methylbutanamide
CID 602764
3-Methyl-1-(1-piperidinyl)-1-butanone
CID 4075318
2-Methyl-1-(2-methylpiperidin-1-yl)propan-1-one
CID 3528259
Propanamide, 2-methyl-N-ethyl-N-hexyl-
CID 91693732
N,N-dicyclohexylcyclobutanecarboxamide
CID 841777

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N,2-dimethylbutanamide?
The IUPAC name of N-cyclohexyl-N,2-dimethylbutanamide (CID 51112447) is N-cyclohexyl-N,2-dimethylbutanamide.
What is the SMILES notation for N-cyclohexyl-N,2-dimethylbutanamide?
The canonical SMILES for N-cyclohexyl-N,2-dimethylbutanamide is CCC(C)C(=O)N(C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N,2-dimethylbutanamide?
The InChIKey is HZBIBTFINCACFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-4-10(2)12(14)13(3)11-8-6-5-7-9-11/h10-11H,4-9H2,1-3H3.
What are the key properties of N-cyclohexyl-N,2-dimethylbutanamide?
N-cyclohexyl-N,2-dimethylbutanamide has a molecular weight of 197.32 g/mol, XLogP of 2.82, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N,2-dimethylbutanamide is sourced from PubChem (CID 51112447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).