N,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide

C11H22N2O — CID 79312888

IUPACN,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide
SMILESCC(C)C(=O)N(C)CC1CCCN1C
InChIInChI=1S/C11H22N2O/c1-9(2)11(14)13(4)8-10-6-5-7-12(10)3/h9-10H,5-8H2,1-4H3
InChIKeyXELYOIBTYKUIGW-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.20
Rot. Bonds3

About N,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide

N,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide (PubChem CID 79312888) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide.

Molecular Properties

Compound NameN,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide
PubChem CID79312888
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide
SMILESCC(C)C(=O)N(C)CC1CCCN1C
InChIInChI=1S/C11H22N2O/c1-9(2)11(14)13(4)8-10-6-5-7-12(10)3/h9-10H,5-8H2,1-4H3
InChIKeyXELYOIBTYKUIGW-UHFFFAOYSA-N
XLogP1.20
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-methyl-N-[[(2S)-1-methylpyrrolidin-2-yl]methyl]propanamide
CID 121226107
(2S)-2-amino-N-methyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]propanamide
CID 96553417
(2S)-2-amino-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]butanamide
CID 79314315
1-methyl-1-[(1-methylpyrrolidin-2-yl)methyl]-3-propan-2-ylurea
CID 116656611
(2S)-2-amino-N,3-dimethyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]butanamide
CID 96553466
(2S)-2-amino-N,3-dimethyl-N-[(1-methylpiperidin-2-yl)methyl]butanamide
CID 66565934
2-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]-2-oxoacetic acid
CID 79315922
N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-(propan-2-ylamino)propanamide
CID 79313817
2-amino-5-methoxy-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pentanamide
CID 81101601
N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperazine-1-carboxamide
CID 79314035
2-(butan-2-ylamino)-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]acetamide
CID 79314481
2-carbamothioyl-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pentanamide
CID 79313782

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide?
The IUPAC name of N,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide (CID 79312888) is N,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide.
What is the SMILES notation for N,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide?
The canonical SMILES for N,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide is CC(C)C(=O)N(C)CC1CCCN1C.
What is the InChIKey of N,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide?
The InChIKey is XELYOIBTYKUIGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9(2)11(14)13(4)8-10-6-5-7-12(10)3/h9-10H,5-8H2,1-4H3.
What are the key properties of N,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide?
N,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide has a molecular weight of 198.31 g/mol, XLogP of 1.20, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide is sourced from PubChem (CID 79312888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).