2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide

C16H32N2O — CID 79195672

IUPAC2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide
SMILESCCC(C)(C)C1CCC(NC(=O)C(C)CNC)CC1
InChIInChI=1S/C16H32N2O/c1-6-16(3,4)13-7-9-14(10-8-13)18-15(19)12(2)11-17-5/h12-14,17H,6-11H2,1-5H3,(H,18,19)
InChIKeyFCSKXYMRDQMWFL-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.95
Rot. Bonds6

About 2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide

2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide (PubChem CID 79195672) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide.

Molecular Properties

Compound Name2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide
PubChem CID79195672
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide
SMILESCCC(C)(C)C1CCC(NC(=O)C(C)CNC)CC1
InChIInChI=1S/C16H32N2O/c1-6-16(3,4)13-7-9-14(10-8-13)18-15(19)12(2)11-17-5/h12-14,17H,6-11H2,1-5H3,(H,18,19)
InChIKeyFCSKXYMRDQMWFL-UHFFFAOYSA-N
XLogP2.95
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-2-methyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide
CID 62727193
5-amino-2-methyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]pentanamide
CID 104683788
(2S)-2-amino-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide;hydrochloride
CID 119272259
(2R)-2-amino-3,3-dimethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]butanamide
CID 103928588
N-cyclohexyl-2-methyl-3-(methylamino)propanamide
CID 79195893
N-cycloheptyl-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119674669
N-[4-(2-methylbutan-2-yl)cyclohexyl]-2-propan-2-yloxyacetamide
CID 112686677
2-amino-3-methoxy-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide;hydrochloride
CID 120983922
2-methyl-3-(methylamino)-N-(oxan-4-yl)propanamide
CID 79195500
N-(2-cyclopropylpropan-2-yl)-2-methyl-3-(methylamino)propanamide
CID 103809622
3-chloro-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide
CID 43696457
ethyl 4-[[2-methyl-3-(methylamino)propanoyl]amino]cyclohexane-1-carboxylate;hydrochloride
CID 119738207

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide?
The IUPAC name of 2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide (CID 79195672) is 2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide.
What is the SMILES notation for 2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide?
The canonical SMILES for 2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide is CCC(C)(C)C1CCC(NC(=O)C(C)CNC)CC1.
What is the InChIKey of 2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide?
The InChIKey is FCSKXYMRDQMWFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-6-16(3,4)13-7-9-14(10-8-13)18-15(19)12(2)11-17-5/h12-14,17H,6-11H2,1-5H3,(H,18,19).
What are the key properties of 2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide?
2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide has a molecular weight of 268.44 g/mol, XLogP of 2.95, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(methylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide is sourced from PubChem (CID 79195672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).