1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine

C17H16N2 — CID 935553

IUPAC1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine
SMILESc1ccc(CNCc2cccc3ccccc23)nc1
InChIInChI=1S/C17H16N2/c1-2-10-17-14(6-1)7-5-8-15(17)12-18-13-16-9-3-4-11-19-16/h1-11,18H,12-13H2
InChIKeyXMKBUKDUNXZFHE-UHFFFAOYSA-N
MW248.33 g/mol
LogP3.52
Rot. Bonds4

About 1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine

1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine (PubChem CID 935553) has the molecular formula C17H16N2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine
PubChem CID935553
Molecular FormulaC17H16N2
Molecular Weight248.33 g/mol
Exact Mass248.13
IUPAC Name1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine
SMILESc1ccc(CNCc2cccc3ccccc23)nc1
InChIInChI=1S/C17H16N2/c1-2-10-17-14(6-1)7-5-8-15(17)12-18-13-16-9-3-4-11-19-16/h1-11,18H,12-13H2
InChIKeyXMKBUKDUNXZFHE-UHFFFAOYSA-N
XLogP3.52
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine
CID 564837
1-(2-methylpyrimidin-4-yl)-N-(naphthalen-1-ylmethyl)methanamine
CID 60960956
1-(2-methylphenyl)-N-(pyridin-2-ylmethyl)methanamine
CID 2759812
1-(2-fluorophenyl)-N-(pyridin-2-ylmethyl)methanamine
CID 1085208
zinc;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;dihydrochloride
CID 73345757
2-bromo-6-[(pyridin-2-ylmethylamino)methyl]phenol
CID 61389966
4-[(pyridin-2-ylmethylamino)methyl]naphthalene-1-carboxamide
CID 141041513
N-[(6-methyl-2-pyridinyl)methyl]-1-pyridin-2-ylmethanamine
CID 15900109
cobalt(3+);bis(2-[(pyridin-2-ylmethylamino)methyl]phenolate);perchlorate
CID 139152391
azanylidyneoxidanium;2-[(pyridin-2-ylmethylamino)methyl]phenolate;ruthenium(2+);dichloride
CID 54576515
naphthalen-1-ylmethyl(pyridin-2-ylmethyl)azanium
CID 7480921
1-(5-bromoquinolin-8-yl)-N-(pyridin-2-ylmethyl)methanamine
CID 115959018

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine?
The IUPAC name of 1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine (CID 935553) is 1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine.
What is the SMILES notation for 1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine?
The canonical SMILES for 1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine is c1ccc(CNCc2cccc3ccccc23)nc1.
What is the InChIKey of 1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine?
The InChIKey is XMKBUKDUNXZFHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2/c1-2-10-17-14(6-1)7-5-8-15(17)12-18-13-16-9-3-4-11-19-16/h1-11,18H,12-13H2.
What are the key properties of 1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine?
1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine has a molecular weight of 248.33 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine is sourced from PubChem (CID 935553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).