N-[2-(methylamino)propyl]pyrrolidine-1-carboxamide

C9H19N3O — CID 103512851

IUPACN-[2-(methylamino)propyl]pyrrolidine-1-carboxamide
SMILESCNC(C)CNC(=O)N1CCCC1
InChIInChI=1S/C9H19N3O/c1-8(10-2)7-11-9(13)12-5-3-4-6-12/h8,10H,3-7H2,1-2H3,(H,11,13)
InChIKeyACTZRPCLBAUIFK-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.40
Rot. Bonds3

About N-[2-(methylamino)propyl]pyrrolidine-1-carboxamide

N-[2-(methylamino)propyl]pyrrolidine-1-carboxamide (PubChem CID 103512851) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is N-[2-(methylamino)propyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-(methylamino)propyl]pyrrolidine-1-carboxamide
PubChem CID103512851
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC NameN-[2-(methylamino)propyl]pyrrolidine-1-carboxamide
SMILESCNC(C)CNC(=O)N1CCCC1
InChIInChI=1S/C9H19N3O/c1-8(10-2)7-11-9(13)12-5-3-4-6-12/h8,10H,3-7H2,1-2H3,(H,11,13)
InChIKeyACTZRPCLBAUIFK-UHFFFAOYSA-N
XLogP0.40
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-methyl-3-(methylamino)propyl]azepane-1-carboxamide
CID 115302691
N-(2,3,3-trimethylbutyl)pyrrolidine-1-carboxamide
CID 115629639
3-(azocane-1-carbonylamino)-2-methylpropanoic acid
CID 62669756
3-(azepane-1-carbonylamino)-2-methylpropanoic acid
CID 62671321
N-(2-methylsulfinylpropyl)pyrrolidine-1-carboxamide
CID 115763587
N-[2-(dimethylamino)propyl]piperidine-1-carboxamide
CID 115581577
N-(2-methylsulfanylpropyl)piperidine-1-carboxamide
CID 115760436
2-(azepan-1-yl)-N-[2-(methylamino)propyl]propanamide
CID 120829070
N-(2-amino-3-hydroxybutyl)piperidine-1-carboxamide
CID 79154941
N-[2-(propan-2-ylamino)ethyl]pyrrolidine-1-carboxamide
CID 79162037
4-methyl-5-(piperidine-1-carbonylamino)pentanoic acid
CID 82682716
N-butan-2-ylpyrrolidine-1-carboxamide
CID 17217776

Frequently Asked Questions

What is the IUPAC name of N-[2-(methylamino)propyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[2-(methylamino)propyl]pyrrolidine-1-carboxamide (CID 103512851) is N-[2-(methylamino)propyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[2-(methylamino)propyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[2-(methylamino)propyl]pyrrolidine-1-carboxamide is CNC(C)CNC(=O)N1CCCC1.
What is the InChIKey of N-[2-(methylamino)propyl]pyrrolidine-1-carboxamide?
The InChIKey is ACTZRPCLBAUIFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-8(10-2)7-11-9(13)12-5-3-4-6-12/h8,10H,3-7H2,1-2H3,(H,11,13).
What are the key properties of N-[2-(methylamino)propyl]pyrrolidine-1-carboxamide?
N-[2-(methylamino)propyl]pyrrolidine-1-carboxamide has a molecular weight of 185.27 g/mol, XLogP of 0.40, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylamino)propyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 103512851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).