N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide

C16H20N2O2 — CID 63754922

IUPACN-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide
SMILESCOCC(N)CN(C)C(=O)c1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O2/c1-18(10-15(17)11-20-2)16(19)14-8-7-12-5-3-4-6-13(12)9-14/h3-9,15H,10-11,17H2,1-2H3
InChIKeyDMGLGJIJKRBOJN-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.89
Rot. Bonds5

About N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide

N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide (PubChem CID 63754922) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide
PubChem CID63754922
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC NameN-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide
SMILESCOCC(N)CN(C)C(=O)c1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O2/c1-18(10-15(17)11-20-2)16(19)14-8-7-12-5-3-4-6-13(12)9-14/h3-9,15H,10-11,17H2,1-2H3
InChIKeyDMGLGJIJKRBOJN-UHFFFAOYSA-N
XLogP1.89
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-3-methoxypropyl)-N-methylbenzamide
CID 63753648
N-(2-amino-3-methoxypropyl)-3-methoxy-N-methylbenzamide
CID 63753839
N-(2-amino-3-methoxypropyl)-N-methyl-4-propan-2-ylbenzamide
CID 63754011
N-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide
CID 55243321
N-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide
CID 63753658
N-(2-amino-3-methoxypropyl)-3-fluoro-N-methylbenzamide
CID 55243516
N-(3-amino-2-methylpropyl)-N-methylnaphthalene-2-carboxamide
CID 54992388
N-(3-amino-4-methoxybutyl)naphthalene-2-carboxamide
CID 106243297
2-amino-3-methoxy-1-naphthalen-2-ylpropan-1-one
CID 116594058
N-(2-cyanopropyl)-N-methylnaphthalene-2-carboxamide
CID 47205391
6-bromo-N-(2-hydroxy-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide
CID 115283349
N-[2-(2-methoxyethylamino)-2-oxoethyl]-N-methylnaphthalene-2-carboxamide
CID 9076484

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide?
The IUPAC name of N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide (CID 63754922) is N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide.
What is the SMILES notation for N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide?
The canonical SMILES for N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide is COCC(N)CN(C)C(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide?
The InChIKey is DMGLGJIJKRBOJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-18(10-15(17)11-20-2)16(19)14-8-7-12-5-3-4-6-13(12)9-14/h3-9,15H,10-11,17H2,1-2H3.
What are the key properties of N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide?
N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 1.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide is sourced from PubChem (CID 63754922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).