N-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide

C16H21N3O — CID 119322310

IUPACN-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide
SMILESCc1cccc2c(CCNC(=O)C3CCCN3)c[nH]c12
InChIInChI=1S/C16H21N3O/c1-11-4-2-5-13-12(10-19-15(11)13)7-9-18-16(20)14-6-3-8-17-14/h2,4-5,10,14,17,19H,3,6-9H2,1H3,(H,18,20)
InChIKeySWEUEIUBYPSFDH-UHFFFAOYSA-N
MW271.36 g/mol
LogP1.89
Rot. Bonds4

About N-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide

N-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide (PubChem CID 119322310) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is N-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide
PubChem CID119322310
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC NameN-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide
SMILESCc1cccc2c(CCNC(=O)C3CCCN3)c[nH]c12
InChIInChI=1S/C16H21N3O/c1-11-4-2-5-13-12(10-19-15(11)13)7-9-18-16(20)14-6-3-8-17-14/h2,4-5,10,14,17,19H,3,6-9H2,1H3,(H,18,20)
InChIKeySWEUEIUBYPSFDH-UHFFFAOYSA-N
XLogP1.89
TPSA56.92 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 51.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(7-methyl-1H-indol-3-yl)ethyl]morpholine-3-carboxamide
CID 119781320
N-[2-(2,6-dimethylphenyl)ethyl]piperidine-2-carboxamide
CID 119326210
N-[3-(1H-indol-3-yl)propyl]pyrrolidine-2-carboxamide
CID 119320797
N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride
CID 119288851
1-[2-(7-methyl-1H-indol-3-yl)ethylcarbamoyl]piperidine-3-carboxylic acid
CID 122003471
N-[2-(7-methyl-1H-indol-3-yl)ethyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119781349
N-[2-(2-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide
CID 119313731
N-[2-(1-benzothiophen-3-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119296484
1-cyclopropyl-2-methyl-3-[2-(7-methyl-1H-indol-3-yl)ethyl]guanidine
CID 111464836
(3R)-N-[2-(7-chloro-1H-indol-3-yl)ethyl]piperidine-3-carboxamide
CID 138057346
N-[2-(3,5-dimethylphenyl)ethyl]pyrrolidine-2-carboxamide
CID 83632123
N-[(2-hydroxycyclopentyl)methyl]-2-(7-methyl-1H-indol-3-yl)acetamide
CID 111471037

Frequently Asked Questions

What is the IUPAC name of N-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide?
The IUPAC name of N-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide (CID 119322310) is N-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for N-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide?
The canonical SMILES for N-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide is Cc1cccc2c(CCNC(=O)C3CCCN3)c[nH]c12.
What is the InChIKey of N-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide?
The InChIKey is SWEUEIUBYPSFDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-11-4-2-5-13-12(10-19-15(11)13)7-9-18-16(20)14-6-3-8-17-14/h2,4-5,10,14,17,19H,3,6-9H2,1H3,(H,18,20).
What are the key properties of N-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide?
N-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide has a molecular weight of 271.36 g/mol, XLogP of 1.89, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(7-methyl-1H-indol-3-yl)ethyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 119322310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).