3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide

C19H28N2O — CID 119950141

IUPAC3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide
SMILESCC1CCC(N(C(=O)CC(N)c2ccccc2)C2CC2)CC1
InChIInChI=1S/C19H28N2O/c1-14-7-9-16(10-8-14)21(17-11-12-17)19(22)13-18(20)15-5-3-2-4-6-15/h2-6,14,16-18H,7-13,20H2,1H3
InChIKeyGLYDJCCJPSPSCT-UHFFFAOYSA-N
MW300.45 g/mol
LogP3.65
Rot. Bonds5

About 3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide

3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide (PubChem CID 119950141) has the molecular formula C19H28N2O and a molecular weight of 300.45 g/mol. Its IUPAC name is 3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide
PubChem CID119950141
Molecular FormulaC19H28N2O
Molecular Weight300.45 g/mol
Exact Mass300.22
IUPAC Name3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide
SMILESCC1CCC(N(C(=O)CC(N)c2ccccc2)C2CC2)CC1
InChIInChI=1S/C19H28N2O/c1-14-7-9-16(10-8-14)21(17-11-12-17)19(22)13-18(20)15-5-3-2-4-6-15/h2-6,14,16-18H,7-13,20H2,1H3
InChIKeyGLYDJCCJPSPSCT-UHFFFAOYSA-N
XLogP3.65
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.45
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 55593817
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CID 61161827
3-amino-N,N-dimethyl-3-phenylpropanamide
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3-amino-N-(cyclohexylmethyl)-N-methyl-3-phenylpropanamide
CID 60963492
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CID 119949645
3-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-phenylpropanamide;hydrochloride
CID 119950307
3-amino-N-(2-cyanoethyl)-N-cyclopropyl-3-phenylpropanamide
CID 54916242
3-amino-N-methyl-N-(1-methylsulfonylpiperidin-4-yl)-3-phenylpropanamide
CID 119952577
3-amino-N-methyl-3-phenyl-N-(thiolan-3-yl)propanamide
CID 43296719
3-amino-N-benzyl-N-(1-cyclopropylethyl)-3-phenylpropanamide
CID 119948804
3-amino-N-ethyl-3-phenyl-N-propan-2-ylpropanamide;hydrochloride
CID 119949409

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide?
The IUPAC name of 3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide (CID 119950141) is 3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide.
What is the SMILES notation for 3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide?
The canonical SMILES for 3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide is CC1CCC(N(C(=O)CC(N)c2ccccc2)C2CC2)CC1.
What is the InChIKey of 3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide?
The InChIKey is GLYDJCCJPSPSCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O/c1-14-7-9-16(10-8-14)21(17-11-12-17)19(22)13-18(20)15-5-3-2-4-6-15/h2-6,14,16-18H,7-13,20H2,1H3.
What are the key properties of 3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide?
3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide has a molecular weight of 300.45 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-cyclopropyl-N-(4-methylcyclohexyl)-3-phenylpropanamide is sourced from PubChem (CID 119950141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).