N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide

C16H20N2O2 — CID 106243297

IUPACN-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide
SMILESCOCC(N)CCNC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O2/c1-20-11-15(17)8-9-18-16(19)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10,15H,8-9,11,17H2,1H3,(H,18,19)
InChIKeyWFAAJNHGLRYVJK-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.93
Rot. Bonds6

About N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide

N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide (PubChem CID 106243297) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide
PubChem CID106243297
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC NameN-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide
SMILESCOCC(N)CCNC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O2/c1-20-11-15(17)8-9-18-16(19)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10,15H,8-9,11,17H2,1H3,(H,18,19)
InChIKeyWFAAJNHGLRYVJK-UHFFFAOYSA-N
XLogP1.93
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide 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-(3-amino-4-methoxybutyl)-3-fluorobenzamide
CID 106243471
N-(3-amino-4-methoxybutyl)-3,5-dimethoxybenzamide
CID 106243059
N-(4-aminopentyl)naphthalene-2-carboxamide
CID 106122722
N-[3-(1-methoxypropan-2-ylamino)-3-oxopropyl]naphthalene-2-carboxamide
CID 46573507
N-(3-amino-4-methoxybutyl)-3-(trifluoromethyl)benzamide
CID 106243205
N-(3-hydroxy-4-methylpentyl)naphthalene-2-carboxamide
CID 111461088
N-(3-hydroxypentyl)naphthalene-2-carboxamide
CID 115703584
2-methyl-4-(naphthalene-2-carbonylamino)butanoic acid
CID 80538465
N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide
CID 63754922
N-(3-propan-2-yloxypropyl)naphthalene-2-carboxamide
CID 110485660
N-propylnaphthalene-2-carboxamide
CID 6624536
N-[2-[(2-methylpropan-2-yl)oxy]ethyl]naphthalene-2-carboxamide
CID 71329089

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide?
The IUPAC name of N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide (CID 106243297) is N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide.
What is the SMILES notation for N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide?
The canonical SMILES for N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide is COCC(N)CCNC(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide?
The InChIKey is WFAAJNHGLRYVJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-20-11-15(17)8-9-18-16(19)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10,15H,8-9,11,17H2,1H3,(H,18,19).
What are the key properties of N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide?
N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 1.93, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide is sourced from PubChem (CID 106243297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).