1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide

C18H26N4O2 — CID 126814287

IUPAC1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide
SMILESCN(CC1CC1)C(=O)C1CCC(=O)N(C2CC2)C1c1ccnn1C
InChIInChI=1S/C18H26N4O2/c1-20(11-12-3-4-12)18(24)14-7-8-16(23)22(13-5-6-13)17(14)15-9-10-19-21(15)2/h9-10,12-14,17H,3-8,11H2,1-2H3
InChIKeyQSQGHFSRKGZLBU-UHFFFAOYSA-N
MW330.43 g/mol
LogP1.73
Rot. Bonds5

About 1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide

1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide (PubChem CID 126814287) has the molecular formula C18H26N4O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is 1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide.

Molecular Properties

Compound Name1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide
PubChem CID126814287
Molecular FormulaC18H26N4O2
Molecular Weight330.43 g/mol
Exact Mass330.21
IUPAC Name1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide
SMILESCN(CC1CC1)C(=O)C1CCC(=O)N(C2CC2)C1c1ccnn1C
InChIInChI=1S/C18H26N4O2/c1-20(11-12-3-4-12)18(24)14-7-8-16(23)22(13-5-6-13)17(14)15-9-10-19-21(15)2/h9-10,12-14,17H,3-8,11H2,1-2H3
InChIKeyQSQGHFSRKGZLBU-UHFFFAOYSA-N
XLogP1.73
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-Pyrazol-1-ylpiperidin-1-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-one
CID 53551260
N-[3-(5-cyclopropyl-1H-pyrazol-1-yl)propyl]-3-(1-methyl-2-piperidinyl)propanamide
CID 72867210
(4aS,9aS)-1-ethyl-9a-methyl-5-[3-(5-methylpyrazol-1-yl)propanoyl]-4,4a,6,7,8,9-hexahydro-3H-pyrido[3,2-b]azepin-2-one
CID 118739986
(4aS,9aS)-1,9a-dimethyl-5-[3-(5-methylpyrazol-1-yl)propanoyl]-4,4a,6,7,8,9-hexahydro-3H-pyrido[3,2-b]azepin-2-one
CID 118739987
rac-(2R,3R)-1-methyl-2-(1-methyl-1H-pyrazol-5-yl)-6-oxopiperidine-3-carboxylic acid
CID 99713738
5-amino-6-(1-ethyl-1H-pyrazol-5-yl)piperidin-2-one
CID 114557867
rac-(5R,6R)-5-amino-6-(1-methyl-1H-pyrazol-5-yl)piperidin-2-one
CID 119031223
rac-(2R,3R)-1-ethyl-2-(1-methyl-1H-pyrazol-5-yl)-6-oxopiperidine-3-carboxylic acid
CID 122155896
(3R*,5S*)-N-[3-(5-cyclopropyl-1H-pyrazol-1-yl)propyl]-5-(pyrrolidin-1-ylcarbonyl)piperidine-3-carboxamide
CID 72913930
(2R,3R)-1-methyl-2-(1-methyl-1H-pyrazol-5-yl)-5-oxopyrrolidine-3-carboxamide
CID 119031944
(4R,5R)-4-amino-1-cyclopropyl-5-(1-methyl-1H-pyrazol-5-yl)pyrrolidin-2-one
CID 119056816
1-Cyclopropyl-5-(2,3-dimethylpyrrolidine-1-carbonyl)-6-(2-methylpyrazol-3-yl)piperidin-2-one
CID 126800449

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide?
The IUPAC name of 1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide (CID 126814287) is 1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide.
What is the SMILES notation for 1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide?
The canonical SMILES for 1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide is CN(CC1CC1)C(=O)C1CCC(=O)N(C2CC2)C1c1ccnn1C.
What is the InChIKey of 1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide?
The InChIKey is QSQGHFSRKGZLBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O2/c1-20(11-12-3-4-12)18(24)14-7-8-16(23)22(13-5-6-13)17(14)15-9-10-19-21(15)2/h9-10,12-14,17H,3-8,11H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide?
1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide has a molecular weight of 330.43 g/mol, XLogP of 1.73, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(cyclopropylmethyl)-N-methyl-2-(2-methylpyrazol-3-yl)-6-oxopiperidine-3-carboxamide is sourced from PubChem (CID 126814287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).