2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine

C16H18N2 — CID 113446872

IUPAC2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine
SMILESNC1(Cc2cccnc2)CCc2ccccc2C1
InChIInChI=1S/C16H18N2/c17-16(10-13-4-3-9-18-12-13)8-7-14-5-1-2-6-15(14)11-16/h1-6,9,12H,7-8,10-11,17H2
InChIKeyRJZGIUJKYSOCSF-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.51
Rot. Bonds2

About 2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine

2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine (PubChem CID 113446872) has the molecular formula C16H18N2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine.

Molecular Properties

Compound Name2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine
PubChem CID113446872
Molecular FormulaC16H18N2
Molecular Weight238.33 g/mol
Exact Mass238.15
IUPAC Name2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine
SMILESNC1(Cc2cccnc2)CCc2ccccc2C1
InChIInChI=1S/C16H18N2/c17-16(10-13-4-3-9-18-12-13)8-7-14-5-1-2-6-15(14)11-16/h1-6,9,12H,7-8,10-11,17H2
InChIKeyRJZGIUJKYSOCSF-UHFFFAOYSA-N
XLogP2.51
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(pyridin-3-ylmethyl)piperidin-4-amine
CID 86277721
1-(pyridin-3-ylmethyl)cyclohexane-1,4-diamine
CID 162146330
2-[(3-methoxyphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine
CID 62620534
3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine
CID 104735900
4-amino-4-(pyridin-3-ylmethyl)piperidine-1-carboxylic acid
CID 166652941
3-methyl-1-(pyridin-3-ylmethyl)cyclohexan-1-amine
CID 104735858
[1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride
CID 86277054
4-tert-butyl-1-(pyridin-3-ylmethyl)cycloheptan-1-amine
CID 104735914
2,2-dimethyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine
CID 104735918
2-[(1-ethylimidazol-2-yl)methyl]-3,4-dihydro-1H-naphthalen-2-amine
CID 79744347
1-(pyridin-3-ylmethyl)cyclopropane-1-carbaldehyde
CID 131187567
2-(2-pyridin-3-ylethyl)-1,3-dihydroindene-2-carboxylic acid
CID 79429073

Frequently Asked Questions

What is the IUPAC name of 2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine?
The IUPAC name of 2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine (CID 113446872) is 2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine.
What is the SMILES notation for 2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine?
The canonical SMILES for 2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine is NC1(Cc2cccnc2)CCc2ccccc2C1.
What is the InChIKey of 2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine?
The InChIKey is RJZGIUJKYSOCSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2/c17-16(10-13-4-3-9-18-12-13)8-7-14-5-1-2-6-15(14)11-16/h1-6,9,12H,7-8,10-11,17H2.
What are the key properties of 2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine?
2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine has a molecular weight of 238.33 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine is sourced from PubChem (CID 113446872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).