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

C16H20N2O — CID 54992388

IUPACN-(3-amino-2-methylpropyl)-N-methylnaphthalene-2-carboxamide
SMILESCC(CN)CN(C)C(=O)c1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O/c1-12(10-17)11-18(2)16(19)15-8-7-13-5-3-4-6-14(13)9-15/h3-9,12H,10-11,17H2,1-2H3
InChIKeySLXBFWHECFMWRI-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.51
Rot. Bonds4

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

N-(3-amino-2-methylpropyl)-N-methylnaphthalene-2-carboxamide (PubChem CID 54992388) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is N-(3-amino-2-methylpropyl)-N-methylnaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(3-amino-2-methylpropyl)-N-methylnaphthalene-2-carboxamide
PubChem CID54992388
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC NameN-(3-amino-2-methylpropyl)-N-methylnaphthalene-2-carboxamide
SMILESCC(CN)CN(C)C(=O)c1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O/c1-12(10-17)11-18(2)16(19)15-8-7-13-5-3-4-6-14(13)9-15/h3-9,12H,10-11,17H2,1-2H3
InChIKeySLXBFWHECFMWRI-UHFFFAOYSA-N
XLogP2.51
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyanopropyl)-N-methylnaphthalene-2-carboxamide
CID 47205391
N-(3-amino-2-methylpropyl)-N-methyl-1,3-benzodioxole-5-carboxamide
CID 54992436
N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide
CID 63754922
N-(2-hydroxyethyl)-N-methylnaphthalene-2-carboxamide
CID 39949841
N-(3-amino-2-methylpropyl)-4-butan-2-yl-N-methylbenzamide
CID 115272388
(2R)-2-amino-1-naphthalen-2-ylpropan-1-one
CID 67852700
N-(2-amino-2-oxoethyl)-N-propan-2-ylnaphthalene-2-carboxamide
CID 4801962
N-[(5-bromothiophen-2-yl)methyl]-N-methylnaphthalene-2-carboxamide
CID 9108829
N-methyl-N-naphthalen-2-ylnaphthalene-2-carboxamide
CID 26904267
[methyl(naphthalene-2-carbonyl)amino] acetate
CID 59280990
(2S)-2-hydroxy-1-naphthalen-2-ylpropan-1-one
CID 10130388
N-tert-butyl-N-methylnaphthalene-2-carboxamide
CID 90337297

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylpropyl)-N-methylnaphthalene-2-carboxamide?
The IUPAC name of N-(3-amino-2-methylpropyl)-N-methylnaphthalene-2-carboxamide (CID 54992388) is N-(3-amino-2-methylpropyl)-N-methylnaphthalene-2-carboxamide.
What is the SMILES notation for N-(3-amino-2-methylpropyl)-N-methylnaphthalene-2-carboxamide?
The canonical SMILES for N-(3-amino-2-methylpropyl)-N-methylnaphthalene-2-carboxamide is CC(CN)CN(C)C(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-(3-amino-2-methylpropyl)-N-methylnaphthalene-2-carboxamide?
The InChIKey is SLXBFWHECFMWRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-12(10-17)11-18(2)16(19)15-8-7-13-5-3-4-6-14(13)9-15/h3-9,12H,10-11,17H2,1-2H3.
What are the key properties of N-(3-amino-2-methylpropyl)-N-methylnaphthalene-2-carboxamide?
N-(3-amino-2-methylpropyl)-N-methylnaphthalene-2-carboxamide has a molecular weight of 256.35 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylpropyl)-N-methylnaphthalene-2-carboxamide is sourced from PubChem (CID 54992388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).