6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole

C14H18N2 — CID 84622007

IUPAC6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole
SMILESCc1ccc2cc(C3CCCN3)[nH]c2c1C
InChIInChI=1S/C14H18N2/c1-9-5-6-11-8-13(12-4-3-7-15-12)16-14(11)10(9)2/h5-6,8,12,15-16H,3-4,7H2,1-2H3
InChIKeyCKWHZTSAPMTMSE-UHFFFAOYSA-N
MW214.31 g/mol
LogP3.21
Rot. Bonds1

About 6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole

6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole (PubChem CID 84622007) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole.

Molecular Properties

Compound Name6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole
PubChem CID84622007
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC Name6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole
SMILESCc1ccc2cc(C3CCCN3)[nH]c2c1C
InChIInChI=1S/C14H18N2/c1-9-5-6-11-8-13(12-4-3-7-15-12)16-14(11)10(9)2/h5-6,8,12,15-16H,3-4,7H2,1-2H3
InChIKeyCKWHZTSAPMTMSE-UHFFFAOYSA-N
XLogP3.21
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

6-chloro-7-methyl-2-piperidin-2-yl-1H-indole
CID 84633377
3-bromo-6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole
CID 84643966
2-[(2S)-azetidin-2-yl]-7-methyl-1H-indole
CID 130706625
2-methyl-4-phenyl-6-pyrrolidin-2-yl-5H-pyrrolo[3,2-d]pyrimidine
CID 67174564
4,5-dimethyl-2-pyrrolidin-2-yl-1H-benzimidazole
CID 25219064
2-methyl-6-[(2S)-pyrrolidin-2-yl]-1H-pyridin-4-one
CID 56838322
3,5-dimethyl-2-[(2S)-pyrrolidin-2-yl]-1H-pyrrole
CID 55293321
5-tert-butyl-2-piperidin-2-yl-1H-indole
CID 84636218
3,6-dimethyl-2-[(2S)-pyrrolidin-2-yl]phenol
CID 96751347
2,3-dimethyl-6-piperidin-2-ylpyridine
CID 84662827
4-phenyl-6-[(2S)-pyrrolidin-2-yl]-5H-pyrrolo[3,2-d]pyrimidine
CID 58425771
2-(5-ethyl-2-methylphenyl)pyrrolidine
CID 117281634

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole?
The IUPAC name of 6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole (CID 84622007) is 6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole.
What is the SMILES notation for 6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole?
The canonical SMILES for 6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole is Cc1ccc2cc(C3CCCN3)[nH]c2c1C.
What is the InChIKey of 6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole?
The InChIKey is CKWHZTSAPMTMSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2/c1-9-5-6-11-8-13(12-4-3-7-15-12)16-14(11)10(9)2/h5-6,8,12,15-16H,3-4,7H2,1-2H3.
What are the key properties of 6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole?
6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole has a molecular weight of 214.31 g/mol, XLogP of 3.21, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyl-2-pyrrolidin-2-yl-1H-indole is sourced from PubChem (CID 84622007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).