N-(4-aminopentyl)naphthalene-2-carboxamide

C16H20N2O — CID 106122722

IUPACN-(4-aminopentyl)naphthalene-2-carboxamide
SMILESCC(N)CCCNC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O/c1-12(17)5-4-10-18-16(19)15-9-8-13-6-2-3-7-14(13)11-15/h2-3,6-9,11-12H,4-5,10,17H2,1H3,(H,18,19)
InChIKeyLZVQOGVSNWKJLQ-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.70
Rot. Bonds5

About N-(4-aminopentyl)naphthalene-2-carboxamide

N-(4-aminopentyl)naphthalene-2-carboxamide (PubChem CID 106122722) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is N-(4-aminopentyl)naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(4-aminopentyl)naphthalene-2-carboxamide
PubChem CID106122722
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC NameN-(4-aminopentyl)naphthalene-2-carboxamide
SMILESCC(N)CCCNC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O/c1-12(17)5-4-10-18-16(19)15-9-8-13-6-2-3-7-14(13)11-15/h2-3,6-9,11-12H,4-5,10,17H2,1H3,(H,18,19)
InChIKeyLZVQOGVSNWKJLQ-UHFFFAOYSA-N
XLogP2.70
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[4-(naphthalene-2-carbonylamino)butyl]naphthalene-2-carboxamide
CID 101181857
N-(4-aminopentyl)-2-naphthalen-2-ylacetamide
CID 106122522
N-(3-aminopropyl)naphthalene-2-carboxamide
CID 24691516
N-(3-propan-2-yloxypropyl)naphthalene-2-carboxamide
CID 110485660
N-pentylnaphthalene-2-carboxamide
CID 91722098
N-(3-hydroxy-4-methylpentyl)naphthalene-2-carboxamide
CID 111461088
2-methyl-4-(naphthalene-2-carbonylamino)butanoic acid
CID 80538465
N-octadecylnaphthalene-2-carboxamide
CID 20549010
N-heptylnaphthalene-2-carboxamide
CID 91722099
N-propylnaphthalene-2-carboxamide
CID 6624536
N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide
CID 106243297
N-(4-aminopentyl)-3,4-dimethoxybenzamide
CID 106122930

Frequently Asked Questions

What is the IUPAC name of N-(4-aminopentyl)naphthalene-2-carboxamide?
The IUPAC name of N-(4-aminopentyl)naphthalene-2-carboxamide (CID 106122722) is N-(4-aminopentyl)naphthalene-2-carboxamide.
What is the SMILES notation for N-(4-aminopentyl)naphthalene-2-carboxamide?
The canonical SMILES for N-(4-aminopentyl)naphthalene-2-carboxamide is CC(N)CCCNC(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-(4-aminopentyl)naphthalene-2-carboxamide?
The InChIKey is LZVQOGVSNWKJLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-12(17)5-4-10-18-16(19)15-9-8-13-6-2-3-7-14(13)11-15/h2-3,6-9,11-12H,4-5,10,17H2,1H3,(H,18,19).
What are the key properties of N-(4-aminopentyl)naphthalene-2-carboxamide?
N-(4-aminopentyl)naphthalene-2-carboxamide has a molecular weight of 256.35 g/mol, XLogP of 2.70, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminopentyl)naphthalene-2-carboxamide is sourced from PubChem (CID 106122722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).