N-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide

C16H23NO — CID 78850523

IUPACN-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide
SMILESCC(C)CN(C(=O)CCc1ccccc1)C1CC1
InChIInChI=1S/C16H23NO/c1-13(2)12-17(15-9-10-15)16(18)11-8-14-6-4-3-5-7-14/h3-7,13,15H,8-12H2,1-2H3
InChIKeyXRSZGUFXRDSNKD-UHFFFAOYSA-N
MW245.37 g/mol
LogP3.27
Rot. Bonds6

About N-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide

N-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide (PubChem CID 78850523) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide
PubChem CID78850523
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC NameN-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide
SMILESCC(C)CN(C(=O)CCc1ccccc1)C1CC1
InChIInChI=1S/C16H23NO/c1-13(2)12-17(15-9-10-15)16(18)11-8-14-6-4-3-5-7-14/h3-7,13,15H,8-12H2,1-2H3
InChIKeyXRSZGUFXRDSNKD-UHFFFAOYSA-N
XLogP3.27
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-[cyclopropyl(3-phenylpropanoyl)amino]-2-methylpropanoic acid
CID 82325252
2-[cyclopropyl(3-phenylpropanoyl)amino]acetic acid
CID 54945801
(2S)-2-amino-N-cyclopropyl-N-(2-methylpropyl)-4-phenylbutanamide
CID 104984034
N-cyclohexyl-N-ethyl-3-phenylpropanamide
CID 670110
2-anilino-N-cyclopropyl-N-(2-methylpropyl)acetamide
CID 60938792
N-cyclopropyl-N-(2-methylpropyl)benzamide
CID 22118809
N-(3-amino-3-sulfanylidenepropyl)-N-cyclopropyl-3-phenylpropanamide
CID 54996606
N-cyclopropyl-N-(2-methylpropyl)-2-[4-(3-oxobutyl)phenoxy]acetamide
CID 60514359
N-(3-aminopropyl)-N-cyclobutyl-3-phenylpropanamide
CID 102873861
N-(2-methoxyethyl)-N-(2-methylpropyl)-3-phenylpropanamide
CID 78853346
N-cyclopropyl-3-(2-fluorophenyl)-N-(3-methylbutyl)propanamide
CID 86985273
N-(2-bromopropyl)-N-methyl-3-phenylpropanamide
CID 80666025

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide?
The IUPAC name of N-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide (CID 78850523) is N-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide.
What is the SMILES notation for N-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide?
The canonical SMILES for N-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide is CC(C)CN(C(=O)CCc1ccccc1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide?
The InChIKey is XRSZGUFXRDSNKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO/c1-13(2)12-17(15-9-10-15)16(18)11-8-14-6-4-3-5-7-14/h3-7,13,15H,8-12H2,1-2H3.
What are the key properties of N-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide?
N-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide has a molecular weight of 245.37 g/mol, XLogP of 3.27, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-methylpropyl)-3-phenylpropanamide is sourced from PubChem (CID 78850523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).