[2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine

C14H19N3O — CID 82384913

IUPAC[2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine
SMILESCOc1cccc2[nH]cc(C3NCCC3CN)c12
InChIInChI=1S/C14H19N3O/c1-18-12-4-2-3-11-13(12)10(8-17-11)14-9(7-15)5-6-16-14/h2-4,8-9,14,16-17H,5-7,15H2,1H3
InChIKeyUEJOSADJWCLXOJ-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.79
Rot. Bonds3

About [2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine

[2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine (PubChem CID 82384913) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is [2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine.

Molecular Properties

Compound Name[2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine
PubChem CID82384913
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name[2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine
SMILESCOc1cccc2[nH]cc(C3NCCC3CN)c12
InChIInChI=1S/C14H19N3O/c1-18-12-4-2-3-11-13(12)10(8-17-11)14-9(7-15)5-6-16-14/h2-4,8-9,14,16-17H,5-7,15H2,1H3
InChIKeyUEJOSADJWCLXOJ-UHFFFAOYSA-N
XLogP1.79
TPSA63.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze [2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine 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

4-methoxy-3-(3-methylpiperidin-4-yl)-1H-indole
CID 114501337
2-[4-(4-methoxy-1H-indol-3-yl)piperidin-1-yl]acetic acid
CID 141141562
[2-(2,4-dimethyl-1H-indol-3-yl)pyrrolidin-3-yl]methanamine
CID 82386121
4-methoxy-1H-indole-3-sulfonyl chloride
CID 24749816
(6-methoxy-1,3,4,5-tetrahydrobenzo[cd]indol-3-yl)methanamine
CID 18466234
3-fluoro-4-methoxy-1H-indole
CID 162696038
4-methoxy-3-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole
CID 170305481
2-(2,6-dimethoxyphenyl)-3-methylpyrrolidine
CID 3362544
3-(2-ethylselanylethyl)-4-methoxy-1H-indole
CID 167475252
N-(1-cyclopropyl-3-hydroxypropyl)-2-(4-methoxy-1H-indol-3-yl)acetamide
CID 110007760
methyl 2-(4-methoxy-1H-indol-3-yl)-2-oxoacetate
CID 53419524
6-amino-N-[2-(4-methoxy-1H-indol-3-yl)ethyl]bicyclo[3.2.0]heptane-3-carboxamide
CID 154772694

Frequently Asked Questions

What is the IUPAC name of [2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine?
The IUPAC name of [2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine (CID 82384913) is [2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine.
What is the SMILES notation for [2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine?
The canonical SMILES for [2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine is COc1cccc2[nH]cc(C3NCCC3CN)c12.
What is the InChIKey of [2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine?
The InChIKey is UEJOSADJWCLXOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-18-12-4-2-3-11-13(12)10(8-17-11)14-9(7-15)5-6-16-14/h2-4,8-9,14,16-17H,5-7,15H2,1H3.
What are the key properties of [2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine?
[2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine has a molecular weight of 245.33 g/mol, XLogP of 1.79, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-methoxy-1H-indol-3-yl)pyrrolidin-3-yl]methanamine is sourced from PubChem (CID 82384913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).