(3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide

C14H22N4O2 — CID 95815536

IUPAC(3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide
SMILESCN(C)C(=O)[C@]1(C)CCCN(C(=O)c2ccn(C)n2)C1
InChIInChI=1S/C14H22N4O2/c1-14(13(20)16(2)3)7-5-8-18(10-14)12(19)11-6-9-17(4)15-11/h6,9H,5,7-8,10H2,1-4H3/t14-/m1/s1
InChIKeyGKYBFLYHYAYGSU-CQSZACIVSA-N
MW278.36 g/mol
LogP0.75
Rot. Bonds2

About (3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide

(3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide (PubChem CID 95815536) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is (3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide
PubChem CID95815536
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name(3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide
SMILESCN(C)C(=O)[C@]1(C)CCCN(C(=O)c2ccn(C)n2)C1
InChIInChI=1S/C14H22N4O2/c1-14(13(20)16(2)3)7-5-8-18(10-14)12(19)11-6-9-17(4)15-11/h6,9H,5,7-8,10H2,1-4H3/t14-/m1/s1
InChIKeyGKYBFLYHYAYGSU-CQSZACIVSA-N
XLogP0.75
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,N,2-trimethyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide
CID 110253416
1,4-dioxa-9-azaspiro[4.5]decan-9-yl-(1-methylpyrazol-3-yl)methanone
CID 103860781
(1-methylpyrazol-3-yl)-piperidin-1-ylmethanone
CID 19577577
[(3S)-3-methyl-3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-methylpyrazol-3-yl)methanone
CID 95848592
[3-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(1-methylpyrazol-3-yl)methanone
CID 110257094
(2,2-dimethylpyrrolidin-1-yl)-(1-methylpyrazol-3-yl)methanone
CID 141314396
[(3S,5R)-3-[(dimethylamino)methyl]-1-oxa-9-azaspiro[4.5]decan-9-yl]-(1-methylpyrazol-3-yl)methanone
CID 97397134
(3S)-N,N-dimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide
CID 95828671
(4-methylpiperazin-1-yl)-(1-methylpyrazol-3-yl)methanone
CID 2172453
N'-hydroxy-4-methyl-1-(1-methylpyrazole-3-carbonyl)piperidine-4-carboximidamide
CID 107162442
1-(1-methylpyrazole-3-carbonyl)piperidin-3-one
CID 103118157
(3-methylazetidin-1-yl)-(1-methylpyrazol-3-yl)methanone
CID 123809651

Frequently Asked Questions

What is the IUPAC name of (3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide (CID 95815536) is (3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide is CN(C)C(=O)[C@]1(C)CCCN(C(=O)c2ccn(C)n2)C1.
What is the InChIKey of (3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide?
The InChIKey is GKYBFLYHYAYGSU-CQSZACIVSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-14(13(20)16(2)3)7-5-8-18(10-14)12(19)11-6-9-17(4)15-11/h6,9H,5,7-8,10H2,1-4H3/t14-/m1/s1.
What are the key properties of (3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide?
(3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide has a molecular weight of 278.36 g/mol, XLogP of 0.75, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 95815536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).