N-cyclohexyl-3-methylbutanamide;methane

C12H25NO — CID 161464891

IUPACN-cyclohexyl-3-methylbutanamide;methane
SMILESC.CC(C)CC(=O)NC1CCCCC1
InChIInChI=1S/C11H21NO.CH4/c1-9(2)8-11(13)12-10-6-4-3-5-7-10;/h9-10H,3-8H2,1-2H3,(H,12,13);1H4
InChIKeyWCHHJNBIONNHKH-UHFFFAOYSA-N
MW199.34 g/mol
LogP3.12
Rot. Bonds3

About N-cyclohexyl-3-methylbutanamide;methane

N-cyclohexyl-3-methylbutanamide;methane (PubChem CID 161464891) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is N-cyclohexyl-3-methylbutanamide;methane.

Molecular Properties

Compound NameN-cyclohexyl-3-methylbutanamide;methane
PubChem CID161464891
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC NameN-cyclohexyl-3-methylbutanamide;methane
SMILESC.CC(C)CC(=O)NC1CCCCC1
InChIInChI=1S/C11H21NO.CH4/c1-9(2)8-11(13)12-10-6-4-3-5-7-10;/h9-10H,3-8H2,1-2H3,(H,12,13);1H4
InChIKeyWCHHJNBIONNHKH-UHFFFAOYSA-N
XLogP3.12
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(13-hydroxy-12,14-dioxa-13-borabicyclo[9.3.1]pentadecan-5-yl)-3-methylbutanamide
CID 174021890
4-amino-N-cyclohexyl-3-methylbutanamide
CID 81070976
N'-cyclohexyl-3-methylbutanehydrazide
CID 22613406
(2S)-4-(cyclohexylamino)-4-oxo-2-propan-2-ylbutanoic acid
CID 58938741
(3S)-3-amino-N-cyclobutylbutanamide
CID 94423965
N-cycloheptyl-N'-cyclopentylpropanediamide
CID 108942189
N-cyclodecylpropanamide
CID 122483649
N-cyclooctylpropanamide
CID 3387497
N-cyclododecylpropanamide
CID 2784600
5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid
CID 62965613
4-amino-N-cyclobutyl-3-methylbutanamide
CID 81086885
3-methyl-N-[(3R)-oxolan-3-yl]butanamide
CID 176873242

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-methylbutanamide;methane?
The IUPAC name of N-cyclohexyl-3-methylbutanamide;methane (CID 161464891) is N-cyclohexyl-3-methylbutanamide;methane.
What is the SMILES notation for N-cyclohexyl-3-methylbutanamide;methane?
The canonical SMILES for N-cyclohexyl-3-methylbutanamide;methane is C.CC(C)CC(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-3-methylbutanamide;methane?
The InChIKey is WCHHJNBIONNHKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO.CH4/c1-9(2)8-11(13)12-10-6-4-3-5-7-10;/h9-10H,3-8H2,1-2H3,(H,12,13);1H4.
What are the key properties of N-cyclohexyl-3-methylbutanamide;methane?
N-cyclohexyl-3-methylbutanamide;methane has a molecular weight of 199.34 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-methylbutanamide;methane is sourced from PubChem (CID 161464891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).