2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide

C9H18N2O — CID 58468710

IUPAC2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide
SMILESCC(C)(C)C(=O)N[C@@H]1CCNC1
InChIInChI=1S/C9H18N2O/c1-9(2,3)8(12)11-7-4-5-10-6-7/h7,10H,4-6H2,1-3H3,(H,11,12)/t7-/m1/s1
InChIKeyDSEXMLJKJZQKFF-SSDOTTSWSA-N
MW170.26 g/mol
LogP0.51
Rot. Bonds1

About 2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide

2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide (PubChem CID 58468710) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide
PubChem CID58468710
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide
SMILESCC(C)(C)C(=O)N[C@@H]1CCNC1
InChIInChI=1S/C9H18N2O/c1-9(2,3)8(12)11-7-4-5-10-6-7/h7,10H,4-6H2,1-3H3,(H,11,12)/t7-/m1/s1
InChIKeyDSEXMLJKJZQKFF-SSDOTTSWSA-N
XLogP0.51
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(azetidin-3-yl)-2,2-dimethylpropanamide
CID 58468718
2,2-difluoro-N-[(3S)-pyrrolidin-3-yl]propanamide
CID 131131747
sulfane;2,2,2-trifluoro-N-[(3S)-pyrrolidin-3-yl]acetamide
CID 161088064
1-pyrrolidin-3-yl-3-[(3R)-pyrrolidin-3-yl]urea
CID 66630468
2-methyl-2-phenyl-N-pyrrolidin-3-ylpropanamide
CID 43603539
2,2-dimethylpropyl N-pyrrolidin-3-ylcarbamate
CID 142337471
2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide
CID 119428227
N-cyclobutyl-2,2-dimethylpropanamide
CID 21051515
2-(4-bromophenyl)-2-methyl-N-pyrrolidin-3-ylpropanamide
CID 119454206
2-(2,2-dimethylpropanoylamino)-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119453622
pyrrolidin-3-ylcarbamic acid;hydrochloride
CID 141142005
1-cyclopropyl-3-[(3R)-pyrrolidin-3-yl]urea
CID 79686058

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide (CID 58468710) is 2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide is CC(C)(C)C(=O)N[C@@H]1CCNC1.
What is the InChIKey of 2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide?
The InChIKey is DSEXMLJKJZQKFF-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H18N2O/c1-9(2,3)8(12)11-7-4-5-10-6-7/h7,10H,4-6H2,1-3H3,(H,11,12)/t7-/m1/s1.
What are the key properties of 2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide?
2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide has a molecular weight of 170.26 g/mol, XLogP of 0.51, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[(3R)-pyrrolidin-3-yl]propanamide is sourced from PubChem (CID 58468710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).