N-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide

C18H28N2O — CID 119771590

IUPACN-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide
SMILESCNCC(C)C(=O)N(CCc1ccccc1)C1CCCC1
InChIInChI=1S/C18H28N2O/c1-15(14-19-2)18(21)20(17-10-6-7-11-17)13-12-16-8-4-3-5-9-16/h3-5,8-9,15,17,19H,6-7,10-14H2,1-2H3
InChIKeySVZJEJFSYNQOBI-UHFFFAOYSA-N
MW288.44 g/mol
LogP2.86
Rot. Bonds7

About N-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide

N-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide (PubChem CID 119771590) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is N-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide.

Molecular Properties

Compound NameN-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide
PubChem CID119771590
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC NameN-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide
SMILESCNCC(C)C(=O)N(CCc1ccccc1)C1CCCC1
InChIInChI=1S/C18H28N2O/c1-15(14-19-2)18(21)20(17-10-6-7-11-17)13-12-16-8-4-3-5-9-16/h3-5,8-9,15,17,19H,6-7,10-14H2,1-2H3
InChIKeySVZJEJFSYNQOBI-UHFFFAOYSA-N
XLogP2.86
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide?
The IUPAC name of N-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide (CID 119771590) is N-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide.
What is the SMILES notation for N-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide?
The canonical SMILES for N-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide is CNCC(C)C(=O)N(CCc1ccccc1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide?
The InChIKey is SVZJEJFSYNQOBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-15(14-19-2)18(21)20(17-10-6-7-11-17)13-12-16-8-4-3-5-9-16/h3-5,8-9,15,17,19H,6-7,10-14H2,1-2H3.
What are the key properties of N-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide?
N-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide has a molecular weight of 288.44 g/mol, XLogP of 2.86, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide is sourced from PubChem (CID 119771590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).