N-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine

C11H19N3 — CID 115210229

IUPACN-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine
SMILESCN(CCC1CCCN1)c1cc[nH]c1
InChIInChI=1S/C11H19N3/c1-14(11-4-7-12-9-11)8-5-10-3-2-6-13-10/h4,7,9-10,12-13H,2-3,5-6,8H2,1H3
InChIKeyHDPZAIFIYLMGKC-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.59
Rot. Bonds4

About N-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine

N-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine (PubChem CID 115210229) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine.

Molecular Properties

Compound NameN-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine
PubChem CID115210229
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine
SMILESCN(CCC1CCCN1)c1cc[nH]c1
InChIInChI=1S/C11H19N3/c1-14(11-4-7-12-9-11)8-5-10-3-2-6-13-10/h4,7,9-10,12-13H,2-3,5-6,8H2,1H3
InChIKeyHDPZAIFIYLMGKC-UHFFFAOYSA-N
XLogP1.59
TPSA31.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethylsulfanyl-N-methyl-N-(2-pyrrolidin-2-ylethyl)aniline
CID 115210239
3,4-dimethoxy-N-methyl-N-(2-pyrrolidin-2-ylethyl)aniline
CID 115210196
3-bromo-4-methoxy-N-methyl-N-(2-pyrrolidin-2-ylethyl)aniline
CID 115210208
3-ethyl-4-methoxy-N-methyl-N-(2-pyrrolidin-2-ylethyl)aniline
CID 115210219
N,N-dimethyl-2-[(2S)-pyrrolidin-2-yl]ethanamine;dihydrochloride
CID 155100868
4-ethoxy-3-fluoro-N-methyl-N-(2-pyrrolidin-2-ylethyl)aniline
CID 115210222
4-fluoro-N-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline
CID 94333109
N,N-dimethyl-2-[(2S)-piperidin-2-yl]ethanamine
CID 7019358
N-methyl-5-propyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine
CID 116978106
N-methyl-N-(2-piperidin-2-ylethyl)cyclohexanamine
CID 43149893
N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine
CID 63209345
N-methyl-N-(2-piperidin-2-ylethyl)-1,3-thiazol-2-amine
CID 83839715

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine?
The IUPAC name of N-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine (CID 115210229) is N-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine.
What is the SMILES notation for N-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine?
The canonical SMILES for N-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine is CN(CCC1CCCN1)c1cc[nH]c1.
What is the InChIKey of N-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine?
The InChIKey is HDPZAIFIYLMGKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-14(11-4-7-12-9-11)8-5-10-3-2-6-13-10/h4,7,9-10,12-13H,2-3,5-6,8H2,1H3.
What are the key properties of N-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine?
N-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine has a molecular weight of 193.29 g/mol, XLogP of 1.59, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-pyrrolidin-2-ylethyl)-1H-pyrrol-3-amine is sourced from PubChem (CID 115210229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).