N-methyl-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxamide

C12H23N3O — CID 118534964

IUPACN-methyl-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1C1CCN(C)CC1
InChIInChI=1S/C12H23N3O/c1-13-12(16)11-4-3-7-15(11)10-5-8-14(2)9-6-10/h10-11H,3-9H2,1-2H3,(H,13,16)
InChIKeyDZXGITYEULBLBE-UHFFFAOYSA-N
MW225.34 g/mol
LogP0.29
Rot. Bonds2

About N-methyl-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxamide

N-methyl-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxamide (PubChem CID 118534964) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is N-methyl-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxamide
PubChem CID118534964
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC NameN-methyl-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1C1CCN(C)CC1
InChIInChI=1S/C12H23N3O/c1-13-12(16)11-4-3-7-15(11)10-5-8-14(2)9-6-10/h10-11H,3-9H2,1-2H3,(H,13,16)
InChIKeyDZXGITYEULBLBE-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

1-cyclobutyl-N-methylpyrrolidine-2-carboxamide
CID 126990833
1-(4-hydroxycyclohexyl)-N-methylpyrrolidine-2-carboxamide
CID 114762479
(2S)-N-methyl-1-piperidin-4-ylpyrrolidine-2-carboxamide
CID 93446902
(2S)-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid
CID 51892046
4-[(2R)-2-(methylcarbamoyl)piperidin-1-yl]piperidine-1-carboxylic acid
CID 118295136
1-(1-methylazepan-4-yl)pyrrolidine-2-carboxylic acid
CID 65073070
1-[4-(ethylamino)cyclohexyl]-N-methylpyrrolidine-2-carboxamide
CID 114763026
(2S)-1-(1-methylpiperidin-4-yl)piperidine-2-carboxylic acid
CID 68690983
N-methyl-1-[4-(propylamino)cyclohexyl]pyrrolidine-2-carboxamide
CID 114763027
1-(1-methylazepan-4-yl)azepane-2-carboxylic acid
CID 65072667
1-[1-(1-methylpiperidin-4-yl)piperidin-2-yl]propan-1-one
CID 147351272
(2S)-1-(1-methylpyrrolidin-3-yl)pyrrolidine-2-carboxylic acid
CID 83618259

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxamide?
The IUPAC name of N-methyl-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxamide (CID 118534964) is N-methyl-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-methyl-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-methyl-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxamide is CNC(=O)C1CCCN1C1CCN(C)CC1.
What is the InChIKey of N-methyl-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxamide?
The InChIKey is DZXGITYEULBLBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-13-12(16)11-4-3-7-15(11)10-5-8-14(2)9-6-10/h10-11H,3-9H2,1-2H3,(H,13,16).
What are the key properties of N-methyl-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxamide?
N-methyl-1-(1-methylpiperidin-4-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-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 118534964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).