N-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine

C17H19N3 — CID 117041626

IUPACN-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine
SMILESCc1[nH]c2ccccc2c1N(C)c1ccc(CN)cc1
InChIInChI=1S/C17H19N3/c1-12-17(15-5-3-4-6-16(15)19-12)20(2)14-9-7-13(11-18)8-10-14/h3-10,19H,11,18H2,1-2H3
InChIKeyFQOJBVQDKUULBF-UHFFFAOYSA-N
MW265.36 g/mol
LogP3.70
Rot. Bonds3

About N-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine

N-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine (PubChem CID 117041626) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine
PubChem CID117041626
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC NameN-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine
SMILESCc1[nH]c2ccccc2c1N(C)c1ccc(CN)cc1
InChIInChI=1S/C17H19N3/c1-12-17(15-5-3-4-6-16(15)19-12)20(2)14-9-7-13(11-18)8-10-14/h3-10,19H,11,18H2,1-2H3
InChIKeyFQOJBVQDKUULBF-UHFFFAOYSA-N
XLogP3.70
TPSA45.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-N-methyl-3-N-(2-methyl-1H-indol-3-yl)benzene-1,3-diamine
CID 117040909
N'-methyl-N'-(2-methyl-1H-indol-3-yl)butane-1,4-diamine
CID 115201113
ethyl 2-[methyl-(2-methyl-1H-indol-3-yl)amino]-2-oxoacetate
CID 115141911
N',2-dimethyl-N'-(2-methyl-1H-indol-3-yl)butane-1,4-diamine
CID 115203083
4-fluoro-2-N-methyl-2-N-(2-methyl-1H-indol-3-yl)benzene-1,2-diamine
CID 115124113
4-bromo-1-N-methyl-1-N-(2-methyl-1H-indol-3-yl)benzene-1,2-diamine
CID 115125393
2-N,3-dimethyl-2-N-(2-methyl-1H-indol-3-yl)pyridine-2,5-diamine
CID 115147900
N-(5-bromo-6-methyl-2-pyridinyl)-N,2-dimethyl-1H-indol-3-amine
CID 115148200
N-[4-(aminomethyl)phenyl]-N,3-dimethylaniline
CID 62001605
bis(2-(2-methyl-1H-indol-3-yl)ethanamine);hydrochloride
CID 169440945
N-methyl-N-(2-methyl-1H-indol-3-yl)-2-sulfanylacetamide
CID 115167052
9H-carbazol-3-ylmethanamine
CID 42281639

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine?
The IUPAC name of N-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine (CID 117041626) is N-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine is Cc1[nH]c2ccccc2c1N(C)c1ccc(CN)cc1.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine?
The InChIKey is FQOJBVQDKUULBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-12-17(15-5-3-4-6-16(15)19-12)20(2)14-9-7-13(11-18)8-10-14/h3-10,19H,11,18H2,1-2H3.
What are the key properties of N-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine?
N-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine has a molecular weight of 265.36 g/mol, XLogP of 3.70, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-N,2-dimethyl-1H-indol-3-amine is sourced from PubChem (CID 117041626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).