2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide

C10H21N3O — CID 63267432

IUPAC2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide
SMILESCCC(C(N)=O)N1CCC(CNC)C1
InChIInChI=1S/C10H21N3O/c1-3-9(10(11)14)13-5-4-8(7-13)6-12-2/h8-9,12H,3-7H2,1-2H3,(H2,11,14)
InChIKeyUHISENNFGOFLSZ-UHFFFAOYSA-N
MW199.30 g/mol
LogP-0.21
Rot. Bonds5

About 2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide

2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide (PubChem CID 63267432) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide.

Molecular Properties

Compound Name2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide
PubChem CID63267432
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide
SMILESCCC(C(N)=O)N1CCC(CNC)C1
InChIInChI=1S/C10H21N3O/c1-3-9(10(11)14)13-5-4-8(7-13)6-12-2/h8-9,12H,3-7H2,1-2H3,(H2,11,14)
InChIKeyUHISENNFGOFLSZ-UHFFFAOYSA-N
XLogP-0.21
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide 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

2-[3-(methylaminomethyl)piperidin-1-yl]butanamide
CID 62899302
2-[4-(1-amino-1-oxobutan-2-yl)-6-hydroxy-1,4-diazepan-1-yl]butanamide
CID 136518009
methyl 2-methyl-3-[3-(methylaminomethyl)pyrrolidin-1-yl]butanoate
CID 79414420
N-methyl-1-(1-pentan-2-ylpyrrolidin-3-yl)methanamine
CID 62511893
2-[3-methyl-4-(propylamino)piperidin-1-yl]butanamide
CID 114499454
(2S)-2-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]butanoic acid
CID 129413724
2-(3,4-dihydroxypyrrolidin-1-yl)butanamide
CID 106672064
2-[4-(methylaminomethyl)piperidin-1-yl]acetamide
CID 63248963
N-methyl-1-(1-octan-4-ylpyrrolidin-3-yl)methanamine
CID 106019244
2-[(3R)-3-methylpiperazin-1-yl]butanamide
CID 104975725
N-cyclopentyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]propanamide;hydrochloride
CID 119922095
2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)butanamide
CID 78945283

Frequently Asked Questions

What is the IUPAC name of 2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide?
The IUPAC name of 2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide (CID 63267432) is 2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide.
What is the SMILES notation for 2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide?
The canonical SMILES for 2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide is CCC(C(N)=O)N1CCC(CNC)C1.
What is the InChIKey of 2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide?
The InChIKey is UHISENNFGOFLSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-3-9(10(11)14)13-5-4-8(7-13)6-12-2/h8-9,12H,3-7H2,1-2H3,(H2,11,14).
What are the key properties of 2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide?
2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide has a molecular weight of 199.30 g/mol, XLogP of -0.21, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(methylaminomethyl)pyrrolidin-1-yl]butanamide is sourced from PubChem (CID 63267432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).