6-pyrrolidin-3-yl-1H-indole

C12H14N2 — CID 82602367

IUPAC6-pyrrolidin-3-yl-1H-indole
SMILESc1cc2ccc(C3CCNC3)cc2[nH]1
InChIInChI=1S/C12H14N2/c1-2-10(11-3-5-13-8-11)7-12-9(1)4-6-14-12/h1-2,4,6-7,11,13-14H,3,5,8H2
InChIKeyXVJHHKJJTTWLHK-UHFFFAOYSA-N
MW186.26 g/mol
LogP2.24
Rot. Bonds1

About 6-pyrrolidin-3-yl-1H-indole

6-pyrrolidin-3-yl-1H-indole (PubChem CID 82602367) has the molecular formula C12H14N2 and a molecular weight of 186.26 g/mol. Its IUPAC name is 6-pyrrolidin-3-yl-1H-indole.

Molecular Properties

Compound Name6-pyrrolidin-3-yl-1H-indole
PubChem CID82602367
Molecular FormulaC12H14N2
Molecular Weight186.26 g/mol
Exact Mass186.12
IUPAC Name6-pyrrolidin-3-yl-1H-indole
SMILESc1cc2ccc(C3CCNC3)cc2[nH]1
InChIInChI=1S/C12H14N2/c1-2-10(11-3-5-13-8-11)7-12-9(1)4-6-14-12/h1-2,4,6-7,11,13-14H,3,5,8H2
InChIKeyXVJHHKJJTTWLHK-UHFFFAOYSA-N
XLogP2.24
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.26
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 6-pyrrolidin-3-yl-1H-indole 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

6-[(2R)-piperazin-2-yl]-1H-indole;hydrochloride
CID 171194380
6-[(2S)-piperazin-2-yl]-1H-indole;hydrochloride
CID 171193744
5-pyrrolidin-3-yl-1H-indazole
CID 82405322
7-pyrrolidin-3-yl-1H-pyrrolo[3,2-c]quinolin-4-amine
CID 151028917
2-cyclohexyl-6-pyrrolidin-3-yl-1H-benzimidazole
CID 82501973
(3S)-3-(4-chloro-3-iodophenyl)pyrrolidine
CID 131162893
3-naphthalen-2-ylpiperidine;hydrochloride
CID 45073830
2-iodo-4-[(3S)-pyrrolidin-3-yl]phenol
CID 130648349
2-bromo-4-pyrrolidin-3-ylphenol
CID 82622109
5-pyrrolidin-3-yl-2,1-benzoxazole
CID 82405036
(3S)-3-(4-chlorophenyl)pyrrolidine;hydrochloride
CID 71742220
3-(4-chloro-3-methylphenyl)pyrrolidine;hydrochloride
CID 169498285

Frequently Asked Questions

What is the IUPAC name of 6-pyrrolidin-3-yl-1H-indole?
The IUPAC name of 6-pyrrolidin-3-yl-1H-indole (CID 82602367) is 6-pyrrolidin-3-yl-1H-indole.
What is the SMILES notation for 6-pyrrolidin-3-yl-1H-indole?
The canonical SMILES for 6-pyrrolidin-3-yl-1H-indole is c1cc2ccc(C3CCNC3)cc2[nH]1.
What is the InChIKey of 6-pyrrolidin-3-yl-1H-indole?
The InChIKey is XVJHHKJJTTWLHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2/c1-2-10(11-3-5-13-8-11)7-12-9(1)4-6-14-12/h1-2,4,6-7,11,13-14H,3,5,8H2.
What are the key properties of 6-pyrrolidin-3-yl-1H-indole?
6-pyrrolidin-3-yl-1H-indole has a molecular weight of 186.26 g/mol, XLogP of 2.24, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pyrrolidin-3-yl-1H-indole is sourced from PubChem (CID 82602367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).