N-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide

C20H25N3O2 — CID 78818923

IUPACN-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide
SMILESCC(C(=O)NC(=O)NC1CCCC1)N(C)c1ccc2ccccc2c1
InChIInChI=1S/C20H25N3O2/c1-14(19(24)22-20(25)21-17-9-5-6-10-17)23(2)18-12-11-15-7-3-4-8-16(15)13-18/h3-4,7-8,11-14,17H,5-6,9-10H2,1-2H3,(H2,21,22,24,25)
InChIKeyYEGYKAQNQHNTOI-UHFFFAOYSA-N
MW339.44 g/mol
LogP3.43
Rot. Bonds4

About N-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide

N-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide (PubChem CID 78818923) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is N-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide.

Molecular Properties

Compound NameN-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide
PubChem CID78818923
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC NameN-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide
SMILESCC(C(=O)NC(=O)NC1CCCC1)N(C)c1ccc2ccccc2c1
InChIInChI=1S/C20H25N3O2/c1-14(19(24)22-20(25)21-17-9-5-6-10-17)23(2)18-12-11-15-7-3-4-8-16(15)13-18/h3-4,7-8,11-14,17H,5-6,9-10H2,1-2H3,(H2,21,22,24,25)
InChIKeyYEGYKAQNQHNTOI-UHFFFAOYSA-N
XLogP3.43
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide?
The IUPAC name of N-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide (CID 78818923) is N-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide.
What is the SMILES notation for N-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide?
The canonical SMILES for N-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide is CC(C(=O)NC(=O)NC1CCCC1)N(C)c1ccc2ccccc2c1.
What is the InChIKey of N-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide?
The InChIKey is YEGYKAQNQHNTOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-14(19(24)22-20(25)21-17-9-5-6-10-17)23(2)18-12-11-15-7-3-4-8-16(15)13-18/h3-4,7-8,11-14,17H,5-6,9-10H2,1-2H3,(H2,21,22,24,25).
What are the key properties of N-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide?
N-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide has a molecular weight of 339.44 g/mol, XLogP of 3.43, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]propanamide is sourced from PubChem (CID 78818923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).