N-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide

C18H16N2O — CID 169111587

IUPACN-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide
SMILESO=CN(Cc1ccccn1)Cc1cccc2ccccc12
InChIInChI=1S/C18H16N2O/c21-14-20(13-17-9-3-4-11-19-17)12-16-8-5-7-15-6-1-2-10-18(15)16/h1-11,14H,12-13H2
InChIKeyMLVPEAQMHXUWEY-UHFFFAOYSA-N
MW276.34 g/mol
LogP3.39
Rot. Bonds5

About N-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide

N-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide (PubChem CID 169111587) has the molecular formula C18H16N2O and a molecular weight of 276.34 g/mol. Its IUPAC name is N-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide.

Molecular Properties

Compound NameN-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide
PubChem CID169111587
Molecular FormulaC18H16N2O
Molecular Weight276.34 g/mol
Exact Mass276.13
IUPAC NameN-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide
SMILESO=CN(Cc1ccccn1)Cc1cccc2ccccc12
InChIInChI=1S/C18H16N2O/c21-14-20(13-17-9-3-4-11-19-17)12-16-8-5-7-15-6-1-2-10-18(15)16/h1-11,14H,12-13H2
InChIKeyMLVPEAQMHXUWEY-UHFFFAOYSA-N
XLogP3.39
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine
CID 935553
(E)-N,N,N',N'-tetrakis(pyridin-2-ylmethyl)ethene-1,2-diamine
CID 22115004
1-[2-[[bis(pyridin-2-ylmethyl)amino]methyl]phenyl]-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 54154120
naphthalen-1-ylmethyl(pyridin-2-ylmethyl)azanium
CID 7480921
N-phenyl-N-(pyridin-2-ylmethyl)formamide
CID 59806637
5-[[(8-hydroxyquinolin-5-yl)methyl-(naphthalen-1-ylmethyl)amino]methyl]quinolin-8-ol
CID 25268547
2-[[bis(pyridin-2-ylmethyl)amino]methyl]aniline
CID 69057347
bis(N-(anthracen-9-ylmethyl)-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine);cobalt
CID 10079223
copper;1-pyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 130339696
N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-2-naphthalen-1-yl-N-(pyridin-2-ylmethyl)acetamide
CID 41056354
1-naphthalen-1-yl-N,N-bis(trimethylsilyl)methanamine
CID 11779651
2-[[(2-oxidophenyl)methyl-(pyridin-2-ylmethyl)amino]methyl]phenolate;bis(oxygen(2-));tungsten
CID 139162848

Frequently Asked Questions

What is the IUPAC name of N-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide?
The IUPAC name of N-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide (CID 169111587) is N-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide.
What is the SMILES notation for N-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide?
The canonical SMILES for N-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide is O=CN(Cc1ccccn1)Cc1cccc2ccccc12.
What is the InChIKey of N-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide?
The InChIKey is MLVPEAQMHXUWEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O/c21-14-20(13-17-9-3-4-11-19-17)12-16-8-5-7-15-6-1-2-10-18(15)16/h1-11,14H,12-13H2.
What are the key properties of N-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide?
N-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide has a molecular weight of 276.34 g/mol, XLogP of 3.39, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide is sourced from PubChem (CID 169111587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).