N-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine

C17H19N3 — CID 117041625

IUPACN-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine
SMILESCN(c1ccc(CN)cc1)c1cn(C)c2ccccc12
InChIInChI=1S/C17H19N3/c1-19-12-17(15-5-3-4-6-16(15)19)20(2)14-9-7-13(11-18)8-10-14/h3-10,12H,11,18H2,1-2H3
InChIKeyFFRDKMURTZRPGJ-UHFFFAOYSA-N
MW265.36 g/mol
LogP3.40
Rot. Bonds3

About N-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine

N-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine (PubChem CID 117041625) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine
PubChem CID117041625
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC NameN-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine
SMILESCN(c1ccc(CN)cc1)c1cn(C)c2ccccc12
InChIInChI=1S/C17H19N3/c1-19-12-17(15-5-3-4-6-16(15)19)20(2)14-9-7-13(11-18)8-10-14/h3-10,12H,11,18H2,1-2H3
InChIKeyFFRDKMURTZRPGJ-UHFFFAOYSA-N
XLogP3.40
TPSA34.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-N,3-N-dimethyl-3-N-(1-methylindol-3-yl)benzene-1,3-diamine
CID 117041066
1-methyl-1-(1-methylindol-3-yl)urea
CID 115168227
1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine
CID 155247618
2-N,4-dimethyl-2-N-(1-methylindol-3-yl)benzene-1,2-diamine
CID 115126289
3-amino-N,2,2-trimethyl-N-(1-methylindol-3-yl)propanamide
CID 115154587
4-amino-1-[methyl-(1-methylindol-3-yl)amino]butan-2-ol
CID 117039109
1-N,3-dimethyl-1-N-(1-methylindol-3-yl)butane-1,3-diamine
CID 115200498
2-N-methyl-2-N-(1-methylindol-3-yl)cyclohexane-1,2-diamine
CID 115117895
[3-(aminomethyl)phenyl]-(1-methylindol-3-yl)methanamine
CID 116936971
methyl 2-[methyl-(1-methylindol-3-yl)amino]acetate
CID 115232780
2-amino-N-(1-methylindol-3-yl)-N-pyridin-4-ylacetamide
CID 19802660
1-N-methyl-1-N-(1-methylindol-3-yl)pentane-1,4-diamine
CID 115203715

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine?
The IUPAC name of N-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine (CID 117041625) is N-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine is CN(c1ccc(CN)cc1)c1cn(C)c2ccccc12.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine?
The InChIKey is FFRDKMURTZRPGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-19-12-17(15-5-3-4-6-16(15)19)20(2)14-9-7-13(11-18)8-10-14/h3-10,12H,11,18H2,1-2H3.
What are the key properties of N-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine?
N-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine has a molecular weight of 265.36 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine is sourced from PubChem (CID 117041625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).