4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide

C10H21N3O — CID 103576832

IUPAC4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide
SMILESCNC(=O)CCCN1CC(C)C(N)C1
InChIInChI=1S/C10H21N3O/c1-8-6-13(7-9(8)11)5-3-4-10(14)12-2/h8-9H,3-7,11H2,1-2H3,(H,12,14)
InChIKeyWAKVRYUYTVWXLO-UHFFFAOYSA-N
MW199.30 g/mol
LogP-0.21
Rot. Bonds4

About 4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide

4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide (PubChem CID 103576832) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide.

Molecular Properties

Compound Name4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide
PubChem CID103576832
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide
SMILESCNC(=O)CCCN1CC(C)C(N)C1
InChIInChI=1S/C10H21N3O/c1-8-6-13(7-9(8)11)5-3-4-10(14)12-2/h8-9H,3-7,11H2,1-2H3,(H,12,14)
InChIKeyWAKVRYUYTVWXLO-UHFFFAOYSA-N
XLogP-0.21
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
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

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Related Compounds

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CID 51712
Valine-pyrrolidide
CID 447256
2-Amino-3-methyl-1-(1-pyrrolidinyl)-1-butanone
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1-Pyrrolidineacetamide, N-(2-((1-methylethyl)amino)-2-oxoethyl)-2-oxo-
CID 3050861
1-Pyrrolidineacetamide, N-(2-amino-2-oxoethyl)-alpha-ethyl-2-oxo-
CID 3050866
N-butyl-1-(3-methylbutyl)-5-oxopyrrolidine-3-carboxamide
CID 3245780
N-isopropyl-1-(3-methylbutyl)-5-oxopyrrolidine-3-carboxamide
CID 3243347
3-Methyl-2-(2-oxopyrrolidin-1-yl)butanamide
CID 11229181
(2S)-N-methyl-2-(2-oxopyrrolidin-1-yl)butanamide
CID 11275430
(2S)-2-(3-methyl-2-oxopyrrolidin-1-yl)butanamide
CID 11344412
(2S)-2-[(4R)-4-methyl-2-oxopyrrolidin-1-yl]butanamide
CID 44367490
N-{2-[Methyl(propan-2-yl)amino]ethyl}-2-(2-oxopyrrolidin-1-yl)acetamide
CID 44374413

Frequently Asked Questions

What is the IUPAC name of 4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide?
The IUPAC name of 4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide (CID 103576832) is 4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide.
What is the SMILES notation for 4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide?
The canonical SMILES for 4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide is CNC(=O)CCCN1CC(C)C(N)C1.
What is the InChIKey of 4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide?
The InChIKey is WAKVRYUYTVWXLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-8-6-13(7-9(8)11)5-3-4-10(14)12-2/h8-9H,3-7,11H2,1-2H3,(H,12,14).
What are the key properties of 4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide?
4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide has a molecular weight of 199.30 g/mol, XLogP of -0.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-amino-4-methylpyrrolidin-1-yl)-N-methylbutanamide is sourced from PubChem (CID 103576832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).