N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide

C12H23N3O — CID 62546250

IUPACN-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide
SMILESCN1CCCC(N(C)C(=O)C2CCCN2)C1
InChIInChI=1S/C12H23N3O/c1-14-8-4-5-10(9-14)15(2)12(16)11-6-3-7-13-11/h10-11,13H,3-9H2,1-2H3
InChIKeyDBJHDWKNFYTMBZ-UHFFFAOYSA-N
MW225.34 g/mol
LogP0.29
Rot. Bonds2

About N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide

N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide (PubChem CID 62546250) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide
PubChem CID62546250
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC NameN-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide
SMILESCN1CCCC(N(C)C(=O)C2CCCN2)C1
InChIInChI=1S/C12H23N3O/c1-14-8-4-5-10(9-14)15(2)12(16)11-6-3-7-13-11/h10-11,13H,3-9H2,1-2H3
InChIKeyDBJHDWKNFYTMBZ-UHFFFAOYSA-N
XLogP0.29
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide
CID 104913856
(2S)-N-cyclohexyl-N-methylpyrrolidine-2-carboxamide
CID 23520170
(2S)-N-[(2S,4R)-1,2-dimethylpiperidin-4-yl]-N-methylpyrrolidine-2-carboxamide
CID 124693314
N-cyclohexyl-N,4-dimethylpiperazine-2-carboxamide
CID 115177979
N-cyclobutyl-N-methylazetidine-2-carboxamide
CID 130908967
(2R)-N-[(2R,4S)-1,2-dimethylpiperidin-4-yl]-N-methylpiperidine-2-carboxamide
CID 125119897
(2S)-N-methyl-N-(3-methylcyclohexyl)pyrrolidine-2-carboxamide
CID 61447107
3-amino-N-methyl-N-(1-methylpiperidin-3-yl)cyclobutane-1-carboxamide
CID 115161473
2-[methyl-(1-methylpiperidin-3-yl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103978705
1-methyl-1-(1-methylpiperidin-3-yl)urea
CID 62546065
2-amino-N-methyl-N-[(3S)-1-methylpiperidin-3-yl]acetamide
CID 66565804
(2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide
CID 93224848

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide?
The IUPAC name of N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide (CID 62546250) is N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide is CN1CCCC(N(C)C(=O)C2CCCN2)C1.
What is the InChIKey of N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide?
The InChIKey is DBJHDWKNFYTMBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-14-8-4-5-10(9-14)15(2)12(16)11-6-3-7-13-11/h10-11,13H,3-9H2,1-2H3.
What are the key properties of N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide?
N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide has a molecular weight of 225.34 g/mol, XLogP of 0.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 62546250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).