N-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide

C12H22N2O2 — CID 119552896

IUPACN-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide
SMILESCN(C(=O)CCC1CCOC1)C1CCNC1
InChIInChI=1S/C12H22N2O2/c1-14(11-4-6-13-8-11)12(15)3-2-10-5-7-16-9-10/h10-11,13H,2-9H2,1H3
InChIKeyDTKAJWQFWIQPSX-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.62
Rot. Bonds4

About N-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide

N-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide (PubChem CID 119552896) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide.

Molecular Properties

Compound NameN-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide
PubChem CID119552896
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide
SMILESCN(C(=O)CCC1CCOC1)C1CCNC1
InChIInChI=1S/C12H22N2O2/c1-14(11-4-6-13-8-11)12(15)3-2-10-5-7-16-9-10/h10-11,13H,2-9H2,1H3
InChIKeyDTKAJWQFWIQPSX-UHFFFAOYSA-N
XLogP0.62
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-(oxolan-3-yl)-N-pyrrolidin-3-ylacetamide
CID 119551379
3-cyclopropyl-N-methyl-N-piperidin-4-ylpropanamide
CID 119441464
N-methyl-N-pyrrolidin-3-ylpropanamide
CID 60807525
N,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide;hydrochloride
CID 119554778
N',N'-diethyl-N-methyl-N-pyrrolidin-3-ylbutanediamide
CID 119554222
N-methyl-3-methylsulfanyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119553749
2-[methyl-[3-(oxolan-3-yl)propanoyl]amino]propanoic acid
CID 119358520
N-(azetidin-3-yl)-3-cyclohexyl-N-methylpropanamide
CID 66185701
N',N'-diethyl-N-methyl-N-pyrrolidin-3-ylpentanediamide
CID 119550914
3-cyclopentyl-N-[2-[methyl(pyrrolidin-3-yl)amino]-2-oxoethyl]propanamide
CID 119550902
N-methyl-N-(oxan-4-ylmethyl)-3-piperidin-3-ylpropanamide
CID 63706973
4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide
CID 119551610

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide?
The IUPAC name of N-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide (CID 119552896) is N-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide.
What is the SMILES notation for N-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide?
The canonical SMILES for N-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide is CN(C(=O)CCC1CCOC1)C1CCNC1.
What is the InChIKey of N-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide?
The InChIKey is DTKAJWQFWIQPSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-14(11-4-6-13-8-11)12(15)3-2-10-5-7-16-9-10/h10-11,13H,2-9H2,1H3.
What are the key properties of N-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide?
N-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide has a molecular weight of 226.32 g/mol, XLogP of 0.62, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(oxolan-3-yl)-N-pyrrolidin-3-ylpropanamide is sourced from PubChem (CID 119552896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).