N-methyl-N-(1-methylpiperidin-4-yl)-1-propan-2-ylpyrrolidine-2-carboxamide

C15H29N3O — CID 20813683

IUPACN-methyl-N-(1-methylpiperidin-4-yl)-1-propan-2-ylpyrrolidine-2-carboxamide
SMILESCC(C)N1CCCC1C(=O)N(C)C1CCN(C)CC1
InChIInChI=1S/C15H29N3O/c1-12(2)18-9-5-6-14(18)15(19)17(4)13-7-10-16(3)11-8-13/h12-14H,5-11H2,1-4H3
InChIKeyRWWYYYJZIMBBAY-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.41
Rot. Bonds3

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

N-methyl-N-(1-methylpiperidin-4-yl)-1-propan-2-ylpyrrolidine-2-carboxamide (PubChem CID 20813683) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is N-methyl-N-(1-methylpiperidin-4-yl)-1-propan-2-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-methylpiperidin-4-yl)-1-propan-2-ylpyrrolidine-2-carboxamide
PubChem CID20813683
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC NameN-methyl-N-(1-methylpiperidin-4-yl)-1-propan-2-ylpyrrolidine-2-carboxamide
SMILESCC(C)N1CCCC1C(=O)N(C)C1CCN(C)CC1
InChIInChI=1S/C15H29N3O/c1-12(2)18-9-5-6-14(18)15(19)17(4)13-7-10-16(3)11-8-13/h12-14H,5-11H2,1-4H3
InChIKeyRWWYYYJZIMBBAY-UHFFFAOYSA-N
XLogP1.41
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2R)-1-propan-2-ylpyrrolidin-2-yl]ethanone
CID 59945997
2,3-dimethyl-4-[methyl-(1-methylpiperidin-4-yl)amino]-4-oxobutanoic acid
CID 103495844
N-methyl-1-propan-2-ylpyrrolidine-2-carboxamide
CID 21355300
tert-butyl (2R)-1-propan-2-ylpyrrolidine-2-carboxylate
CID 115320230
ethane;1-propan-2-ylpiperidine-2-carboxylic acid
CID 144742898
N-(4-hydroxycyclohexyl)-N,1-dimethylpiperidine-4-carboxamide
CID 115277411
6-[methyl-(1-methylpiperidin-4-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 16790610
1-propan-2-yl-2-prop-1-en-2-ylpyrrolidine
CID 67564463
5-amino-N,2-dimethyl-N-(1-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 62781149
(3R)-N-cyclohexyl-N,1-dimethylpyrrolidine-3-carboxamide
CID 134459454
(3S)-N-cyclohexyl-N,1-dimethylpyrrolidine-3-carboxamide
CID 134459471
[3-(diethylamino)pyrrolidin-1-yl]-(1-propan-2-ylpyrrolidin-2-yl)methanone
CID 154844605

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-1-propan-2-ylpyrrolidine-2-carboxamide?
The IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-1-propan-2-ylpyrrolidine-2-carboxamide (CID 20813683) is N-methyl-N-(1-methylpiperidin-4-yl)-1-propan-2-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-methyl-N-(1-methylpiperidin-4-yl)-1-propan-2-ylpyrrolidine-2-carboxamide?
The canonical SMILES for N-methyl-N-(1-methylpiperidin-4-yl)-1-propan-2-ylpyrrolidine-2-carboxamide is CC(C)N1CCCC1C(=O)N(C)C1CCN(C)CC1.
What is the InChIKey of N-methyl-N-(1-methylpiperidin-4-yl)-1-propan-2-ylpyrrolidine-2-carboxamide?
The InChIKey is RWWYYYJZIMBBAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-12(2)18-9-5-6-14(18)15(19)17(4)13-7-10-16(3)11-8-13/h12-14H,5-11H2,1-4H3.
What are the key properties of N-methyl-N-(1-methylpiperidin-4-yl)-1-propan-2-ylpyrrolidine-2-carboxamide?
N-methyl-N-(1-methylpiperidin-4-yl)-1-propan-2-ylpyrrolidine-2-carboxamide has a molecular weight of 267.42 g/mol, XLogP of 1.41, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylpiperidin-4-yl)-1-propan-2-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 20813683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).