N-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine

C18H18N2 — CID 115212943

IUPACN-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine
SMILESNCc1cccc(CNc2ccc3ccccc3c2)c1
InChIInChI=1S/C18H18N2/c19-12-14-4-3-5-15(10-14)13-20-18-9-8-16-6-1-2-7-17(16)11-18/h1-11,20H,12-13,19H2
InChIKeyNHMNWFPEAKVAHL-UHFFFAOYSA-N
MW262.36 g/mol
LogP3.91
Rot. Bonds4

About N-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine

N-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine (PubChem CID 115212943) has the molecular formula C18H18N2 and a molecular weight of 262.36 g/mol. Its IUPAC name is N-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine.

Molecular Properties

Compound NameN-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine
PubChem CID115212943
Molecular FormulaC18H18N2
Molecular Weight262.36 g/mol
Exact Mass262.15
IUPAC NameN-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine
SMILESNCc1cccc(CNc2ccc3ccccc3c2)c1
InChIInChI=1S/C18H18N2/c19-12-14-4-3-5-15(10-14)13-20-18-9-8-16-6-1-2-7-17(16)11-18/h1-11,20H,12-13,19H2
InChIKeyNHMNWFPEAKVAHL-UHFFFAOYSA-N
XLogP3.91
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(naphthalen-2-ylamino)methyl]phenol
CID 43680286
3-[(naphthalen-2-ylamino)methyl]benzamide
CID 43533069
N-[[6-[(naphthalen-2-ylamino)methyl]-2-pyridinyl]methyl]naphthalen-2-amine
CID 21130226
N-[[3-(aminomethyl)phenyl]methyl]-3-fluoroaniline
CID 105488137
4-[(naphthalen-2-ylamino)methyl]phenol
CID 13418576
N-[[3-(aminomethyl)phenyl]methyl]pyridin-4-amine
CID 43589478
N-[(4-chlorophenyl)methyl]naphthalen-2-amine
CID 13418586
N-[[3-(aminomethyl)phenyl]methyl]-4-propylaniline
CID 115212901
3-bromo-N-(naphthalen-2-ylmethyl)aniline
CID 28555096
N-[(4-bromo-3-methylphenyl)methyl]naphthalen-2-amine
CID 66475011
N-[(3-bromo-4-fluorophenyl)methyl]naphthalen-2-amine
CID 43533079
N-[[3-(aminomethyl)phenyl]methyl]-4-ethylsulfonylaniline
CID 60871436

Frequently Asked Questions

What is the IUPAC name of N-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine?
The IUPAC name of N-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine (CID 115212943) is N-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine.
What is the SMILES notation for N-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine?
The canonical SMILES for N-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine is NCc1cccc(CNc2ccc3ccccc3c2)c1.
What is the InChIKey of N-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine?
The InChIKey is NHMNWFPEAKVAHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2/c19-12-14-4-3-5-15(10-14)13-20-18-9-8-16-6-1-2-7-17(16)11-18/h1-11,20H,12-13,19H2.
What are the key properties of N-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine?
N-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine has a molecular weight of 262.36 g/mol, XLogP of 3.91, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine is sourced from PubChem (CID 115212943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).