3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide

C8H17N3O — CID 130616618

IUPAC3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide
SMILESCC(CN)C(=O)NC1CCNC1
InChIInChI=1S/C8H17N3O/c1-6(4-9)8(12)11-7-2-3-10-5-7/h6-7,10H,2-5,9H2,1H3,(H,11,12)
InChIKeyIIVKRLKBPGMOAY-UHFFFAOYSA-N
MW171.24 g/mol
LogP-0.94
Rot. Bonds3

About 3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide

3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide (PubChem CID 130616618) has the molecular formula C8H17N3O and a molecular weight of 171.24 g/mol. Its IUPAC name is 3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide.

Molecular Properties

Compound Name3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide
PubChem CID130616618
Molecular FormulaC8H17N3O
Molecular Weight171.24 g/mol
Exact Mass171.14
IUPAC Name3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide
SMILESCC(CN)C(=O)NC1CCNC1
InChIInChI=1S/C8H17N3O/c1-6(4-9)8(12)11-7-2-3-10-5-7/h6-7,10H,2-5,9H2,1H3,(H,11,12)
InChIKeyIIVKRLKBPGMOAY-UHFFFAOYSA-N
XLogP-0.94
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 5-0.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-acetylpiperidin-4-yl)-3-amino-2-methylpropanamide
CID 62671383
4-[(3-amino-2-methylpropanoyl)amino]cyclohexane-1-carboxamide
CID 62670323
3,3,3-trifluoro-2-methyl-N-pyrrolidin-3-ylpropanamide
CID 119449946
N-(azetidin-3-yl)-2-methylbutanamide
CID 66188169
2-methoxy-N-[(3S)-piperidin-3-yl]propanamide
CID 103866505
1-pyrrolidin-3-yl-3-[(3R)-pyrrolidin-3-yl]urea
CID 66630468
N-pyrrolidin-3-ylpropanamide
CID 18337238
ethyl N-pyrrolidin-3-ylcarbamate
CID 11321104
2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride
CID 53256452
2-(azepan-1-yl)-N-pyrrolidin-3-ylpropanamide
CID 119450526
3-(4-fluorophenyl)sulfonyl-2-methyl-N-pyrrolidin-3-ylpropanamide
CID 119451309
2-(cyclohexylmethyl)-3-methyl-N-pyrrolidin-3-ylbutanamide
CID 119452441

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide?
The IUPAC name of 3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide (CID 130616618) is 3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide.
What is the SMILES notation for 3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide?
The canonical SMILES for 3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide is CC(CN)C(=O)NC1CCNC1.
What is the InChIKey of 3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide?
The InChIKey is IIVKRLKBPGMOAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O/c1-6(4-9)8(12)11-7-2-3-10-5-7/h6-7,10H,2-5,9H2,1H3,(H,11,12).
What are the key properties of 3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide?
3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide has a molecular weight of 171.24 g/mol, XLogP of -0.94, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methyl-N-pyrrolidin-3-ylpropanamide is sourced from PubChem (CID 130616618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).