4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride

C17H17ClN2 — CID 2947134

IUPAC4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride
SMILESCc1ccnc(NCc2cccc3ccccc23)c1.Cl
InChIInChI=1S/C17H16N2.ClH/c1-13-9-10-18-17(11-13)19-12-15-7-4-6-14-5-2-3-8-16(14)15;/h2-11H,12H2,1H3,(H,18,19);1H
InChIKeyYERJTAIPYSVKQV-UHFFFAOYSA-N
MW284.79 g/mol
LogP4.58
Rot. Bonds3

About 4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride

4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride (PubChem CID 2947134) has the molecular formula C17H17ClN2 and a molecular weight of 284.79 g/mol. Its IUPAC name is 4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride.

Molecular Properties

Compound Name4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride
PubChem CID2947134
Molecular FormulaC17H17ClN2
Molecular Weight284.79 g/mol
Exact Mass284.11
IUPAC Name4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride
SMILESCc1ccnc(NCc2cccc3ccccc23)c1.Cl
InChIInChI=1S/C17H16N2.ClH/c1-13-9-10-18-17(11-13)19-12-15-7-4-6-14-5-2-3-8-16(14)15;/h2-11H,12H2,1H3,(H,18,19);1H
InChIKeyYERJTAIPYSVKQV-UHFFFAOYSA-N
XLogP4.58
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.79
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Benzylamino)pyridine
CID 23362
1-Isoquinolinamine
CID 73742
WZ 811
CID 11565518
2-Pyridinamine, 4-methyl-N-(phenylmethyl)-
CID 83053
5-Phenyl-2-pyridinamine
CID 105097
Isoquinolin-3-Amine
CID 311869
N-cyclohexyl-4-methylpyridin-2-amine
CID 2366458
Thiourea, N-(5-methyl-2-pyridinyl)-N'-(2-phenylethyl)-
CID 971434
2-N-[3-(diethylamino)propyl]-6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine
CID 5328118
1-(Piperazin-1-yl)isoquinoline
CID 15887436
1-Ethyl-3-[8-methyl-5-(2-methylpyridin-4-yl)isoquinolin-3-yl]urea
CID 67448852
(6aR)-4-benzyl-6,6a,7,8,9,10-hexahydro-5H-pyrazino[1,2-a][1,8]naphthyridine
CID 134265620

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride?
The IUPAC name of 4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride (CID 2947134) is 4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride.
What is the SMILES notation for 4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride?
The canonical SMILES for 4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride is Cc1ccnc(NCc2cccc3ccccc23)c1.Cl.
What is the InChIKey of 4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride?
The InChIKey is YERJTAIPYSVKQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2.ClH/c1-13-9-10-18-17(11-13)19-12-15-7-4-6-14-5-2-3-8-16(14)15;/h2-11H,12H2,1H3,(H,18,19);1H.
What are the key properties of 4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride?
4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride has a molecular weight of 284.79 g/mol, XLogP of 4.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine;hydrochloride is sourced from PubChem (CID 2947134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).