N-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride

C20H26ClN3O2 — CID 119821243

IUPACN-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride
SMILESCC(N)CC(=O)N1CCCC(NC(=O)c2ccc3ccccc3c2)C1.Cl
InChIInChI=1S/C20H25N3O2.ClH/c1-14(21)11-19(24)23-10-4-7-18(13-23)22-20(25)17-9-8-15-5-2-3-6-16(15)12-17;/h2-3,5-6,8-9,12,14,18H,4,7,10-11,13,21H2,1H3,(H,22,25);1H
InChIKeyOAXNOJGTBQMICG-UHFFFAOYSA-N
MW375.90 g/mol
LogP2.72
Rot. Bonds4

About N-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride

N-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride (PubChem CID 119821243) has the molecular formula C20H26ClN3O2 and a molecular weight of 375.90 g/mol. Its IUPAC name is N-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride
PubChem CID119821243
Molecular FormulaC20H26ClN3O2
Molecular Weight375.90 g/mol
Exact Mass375.17
IUPAC NameN-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride
SMILESCC(N)CC(=O)N1CCCC(NC(=O)c2ccc3ccccc3c2)C1.Cl
InChIInChI=1S/C20H25N3O2.ClH/c1-14(21)11-19(24)23-10-4-7-18(13-23)22-20(25)17-9-8-15-5-2-3-6-16(15)12-17;/h2-3,5-6,8-9,12,14,18H,4,7,10-11,13,21H2,1H3,(H,22,25);1H
InChIKeyOAXNOJGTBQMICG-UHFFFAOYSA-N
XLogP2.72
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.90
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(2-amino-3-methoxypropanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride
CID 120992282
N-[1-(3-aminobutanoyl)piperidin-3-yl]-2-methylpropanamide;hydrochloride
CID 119761594
N-[1-(3-aminobutanoyl)piperidin-4-yl]-4-fluorobenzamide;hydrochloride
CID 119709967
3-amino-1-[3-(3,5-dimethoxyanilino)piperidin-1-yl]butan-1-one
CID 120873076
N-[3-[4-(1-aminoethyl)piperidin-1-yl]-3-oxopropyl]naphthalene-2-carboxamide;hydrochloride
CID 119520156
N-[1-(3-aminobutanoyl)piperidin-3-yl]methanesulfonamide
CID 54871310
1-(3-aminobutanoyl)-N-phenylpiperidine-3-carboxamide
CID 119697874
N-[2-oxo-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]ethyl]naphthalene-2-carboxamide
CID 41441224
N-[1-(2-aminoacetyl)pyrrolidin-3-yl]-3-hydroxybenzamide
CID 151293594
N-(4-aminopentyl)naphthalene-2-carboxamide
CID 106122722
2-methyl-N-[1-(2-phenylacetyl)piperidin-3-yl]propanamide
CID 127187955
N-[(3R)-1-(4-methylbenzoyl)piperidin-3-yl]benzamide
CID 59294620

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride?
The IUPAC name of N-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride (CID 119821243) is N-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride?
The canonical SMILES for N-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride is CC(N)CC(=O)N1CCCC(NC(=O)c2ccc3ccccc3c2)C1.Cl.
What is the InChIKey of N-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride?
The InChIKey is OAXNOJGTBQMICG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2.ClH/c1-14(21)11-19(24)23-10-4-7-18(13-23)22-20(25)17-9-8-15-5-2-3-6-16(15)12-17;/h2-3,5-6,8-9,12,14,18H,4,7,10-11,13,21H2,1H3,(H,22,25);1H.
What are the key properties of N-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride?
N-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride has a molecular weight of 375.90 g/mol, XLogP of 2.72, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-aminobutanoyl)piperidin-3-yl]naphthalene-2-carboxamide;hydrochloride is sourced from PubChem (CID 119821243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).