4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide

C12H19N5O2 — CID 75462464

IUPAC4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide
SMILESCC(=O)N(C)C1CCN(C(=O)Nc2cn[nH]c2)CC1
InChIInChI=1S/C12H19N5O2/c1-9(18)16(2)11-3-5-17(6-4-11)12(19)15-10-7-13-14-8-10/h7-8,11H,3-6H2,1-2H3,(H,13,14)(H,15,19)
InChIKeyYCPMEFYPWPGCID-UHFFFAOYSA-N
MW265.32 g/mol
LogP0.88
Rot. Bonds2

About 4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide

4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide (PubChem CID 75462464) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is 4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide
PubChem CID75462464
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC Name4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide
SMILESCC(=O)N(C)C1CCN(C(=O)Nc2cn[nH]c2)CC1
InChIInChI=1S/C12H19N5O2/c1-9(18)16(2)11-3-5-17(6-4-11)12(19)15-10-7-13-14-8-10/h7-8,11H,3-6H2,1-2H3,(H,13,14)(H,15,19)
InChIKeyYCPMEFYPWPGCID-UHFFFAOYSA-N
XLogP0.88
TPSA81.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-(4-methylpiperidine-1-carbonyl)-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 52858730
(3R)-1-(1H-pyrazol-4-ylcarbamoyl)piperidine-3-carboxylic acid
CID 81120212
(3S)-3-N-phenyl-1-N-(1H-pyrazol-4-yl)piperidine-1,3-dicarboxamide
CID 95156850
1-N-(3,5-difluorophenyl)-3-N-(1H-pyrazol-4-yl)pyrrolidine-1,3-dicarboxamide
CID 126841029
3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 47388339
1-butanoyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide
CID 87033981
2-[3-methyl-1-(1H-pyrazol-4-ylcarbamoyl)azetidin-3-yl]oxyacetic acid
CID 102658595
4-[1-[3-(difluoromethyl)-1-methylpyrazol-4-yl]sulfonyl-1-fluoroethyl]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 122484400
N-cyclohexyl-N-methyl-2-(1H-pyrazol-4-ylcarbamoylamino)benzamide
CID 154775138
N-[4-[3-[acetyl(methyl)amino]pyrrolidin-1-yl]phenyl]-4-(4-methylphenoxy)piperidine-1-carboxamide
CID 58867051
2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide
CID 79506371
ethyl 4-(1H-pyrazol-4-ylamino)piperidine-1-carboxylate
CID 43776811

Frequently Asked Questions

What is the IUPAC name of 4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide?
The IUPAC name of 4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide (CID 75462464) is 4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide.
What is the SMILES notation for 4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide?
The canonical SMILES for 4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide is CC(=O)N(C)C1CCN(C(=O)Nc2cn[nH]c2)CC1.
What is the InChIKey of 4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide?
The InChIKey is YCPMEFYPWPGCID-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-9(18)16(2)11-3-5-17(6-4-11)12(19)15-10-7-13-14-8-10/h7-8,11H,3-6H2,1-2H3,(H,13,14)(H,15,19).
What are the key properties of 4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide?
4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide has a molecular weight of 265.32 g/mol, XLogP of 0.88, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[acetyl(methyl)amino]-N-(1H-pyrazol-4-yl)piperidine-1-carboxamide is sourced from PubChem (CID 75462464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).