N'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine

C7H17N3 — CID 68769728

IUPACN'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine
SMILESCN(CCN)C1CCCN1
InChIInChI=1S/C7H17N3/c1-10(6-4-8)7-3-2-5-9-7/h7,9H,2-6,8H2,1H3
InChIKeyLROCHQHWTZBGFK-UHFFFAOYSA-N
MW143.23 g/mol
LogP-0.41
Rot. Bonds3

About N'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine

N'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine (PubChem CID 68769728) has the molecular formula C7H17N3 and a molecular weight of 143.23 g/mol. Its IUPAC name is N'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine.

Molecular Properties

Compound NameN'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine
PubChem CID68769728
Molecular FormulaC7H17N3
Molecular Weight143.23 g/mol
Exact Mass143.14
IUPAC NameN'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine
SMILESCN(CCN)C1CCCN1
InChIInChI=1S/C7H17N3/c1-10(6-4-8)7-3-2-5-9-7/h7,9H,2-6,8H2,1H3
InChIKeyLROCHQHWTZBGFK-UHFFFAOYSA-N
XLogP-0.41
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine 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

N,N-dimethylpyrrolidin-2-amine
CID 18761762
N-methyl-N-(2-pyridin-4-ylsulfanylethyl)pyrrolidin-2-amine
CID 10220343
N-butyl-N-propylpyrrolidin-2-amine
CID 90707555
N-ethyl-N-methylazetidin-2-amine
CID 123787719
2-N-(2-aminoethyl)-1-N,1-N,2-N-trimethylcyclohexane-1,2-diamine;hydrochloride
CID 155906377
(2R)-N-(4-benzylphenyl)-N-methylpyrrolidin-2-amine
CID 174743645
butyl N-methyl-N-pyrrolidin-2-ylcarbamate
CID 66820260
N,N-diethylazepan-2-amine
CID 174564826
2-pyrrolidin-2-ylethanamine
CID 14030009
N,N-dimethyl-2-[(2S)-pyrrolidin-2-yl]ethanamine;dihydrochloride
CID 155100868
N'-(1-cyclohexylpiperidin-3-yl)-N'-methylethane-1,2-diamine
CID 117004717
(2R)-N-methyl-N-(4-phenoxyphenyl)pyrrolidin-2-amine
CID 69325142

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine?
The IUPAC name of N'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine (CID 68769728) is N'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine.
What is the SMILES notation for N'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine?
The canonical SMILES for N'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine is CN(CCN)C1CCCN1.
What is the InChIKey of N'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine?
The InChIKey is LROCHQHWTZBGFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3/c1-10(6-4-8)7-3-2-5-9-7/h7,9H,2-6,8H2,1H3.
What are the key properties of N'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine?
N'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine has a molecular weight of 143.23 g/mol, XLogP of -0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N'-pyrrolidin-2-ylethane-1,2-diamine is sourced from PubChem (CID 68769728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).