(1-methylindol-3-yl)-naphthalen-2-ylmethanamine

C20H18N2 — CID 101394090

IUPAC(1-methylindol-3-yl)-naphthalen-2-ylmethanamine
SMILESCn1cc(C(N)c2ccc3ccccc3c2)c2ccccc21
InChIInChI=1S/C20H18N2/c1-22-13-18(17-8-4-5-9-19(17)22)20(21)16-11-10-14-6-2-3-7-15(14)12-16/h2-13,20H,21H2,1H3
InChIKeyCXUNEKMZIUMCMZ-UHFFFAOYSA-N
MW286.38 g/mol
LogP4.38
Rot. Bonds2

About (1-methylindol-3-yl)-naphthalen-2-ylmethanamine

(1-methylindol-3-yl)-naphthalen-2-ylmethanamine (PubChem CID 101394090) has the molecular formula C20H18N2 and a molecular weight of 286.38 g/mol. Its IUPAC name is (1-methylindol-3-yl)-naphthalen-2-ylmethanamine.

Molecular Properties

Compound Name(1-methylindol-3-yl)-naphthalen-2-ylmethanamine
PubChem CID101394090
Molecular FormulaC20H18N2
Molecular Weight286.38 g/mol
Exact Mass286.15
IUPAC Name(1-methylindol-3-yl)-naphthalen-2-ylmethanamine
SMILESCn1cc(C(N)c2ccc3ccccc3c2)c2ccccc21
InChIInChI=1S/C20H18N2/c1-22-13-18(17-8-4-5-9-19(17)22)20(21)16-11-10-14-6-2-3-7-15(14)12-16/h2-13,20H,21H2,1H3
InChIKeyCXUNEKMZIUMCMZ-UHFFFAOYSA-N
XLogP4.38
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-(aminomethyl)phenyl]-(1-methylindol-3-yl)methanamine
CID 116936971
1-methyl-3-propan-2-ylindole
CID 10942942
(1,5-dimethylpyrazol-4-yl)-naphthalen-2-ylmethanamine
CID 105141685
(2-methoxyphenyl)-naphthalen-2-ylmethanamine
CID 62715547
methoxy-(1-methylindol-3-yl)methanamine
CID 116947283
(1S)-2,2-dimethyl-1-(1-methylindol-3-yl)propan-1-amine;hydrochloride
CID 171241948
(2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine
CID 115850991
1-naphthalen-2-ylethanamine
CID 3857145
3-[(4-fluorophenyl)-(1-methylindol-3-yl)methyl]-1-methylindole
CID 66555482
(5-bromo-2-methylphenyl)-naphthalen-2-ylmethanamine
CID 115851118
(1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine
CID 14048524
3-(1-chloroethyl)-1-methylindole
CID 174876256

Frequently Asked Questions

What is the IUPAC name of (1-methylindol-3-yl)-naphthalen-2-ylmethanamine?
The IUPAC name of (1-methylindol-3-yl)-naphthalen-2-ylmethanamine (CID 101394090) is (1-methylindol-3-yl)-naphthalen-2-ylmethanamine.
What is the SMILES notation for (1-methylindol-3-yl)-naphthalen-2-ylmethanamine?
The canonical SMILES for (1-methylindol-3-yl)-naphthalen-2-ylmethanamine is Cn1cc(C(N)c2ccc3ccccc3c2)c2ccccc21.
What is the InChIKey of (1-methylindol-3-yl)-naphthalen-2-ylmethanamine?
The InChIKey is CXUNEKMZIUMCMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2/c1-22-13-18(17-8-4-5-9-19(17)22)20(21)16-11-10-14-6-2-3-7-15(14)12-16/h2-13,20H,21H2,1H3.
What are the key properties of (1-methylindol-3-yl)-naphthalen-2-ylmethanamine?
(1-methylindol-3-yl)-naphthalen-2-ylmethanamine has a molecular weight of 286.38 g/mol, XLogP of 4.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylindol-3-yl)-naphthalen-2-ylmethanamine is sourced from PubChem (CID 101394090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).