N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide

C13H22N4O — CID 580065

IUPACN-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide
SMILESCC1(C)CC(NC(=O)c2ccn[nH]2)CC(C)(C)N1
InChIInChI=1S/C13H22N4O/c1-12(2)7-9(8-13(3,4)17-12)15-11(18)10-5-6-14-16-10/h5-6,9,17H,7-8H2,1-4H3,(H,14,16)(H,15,18)
InChIKeyKRCPLLRGUAVQQY-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.45
Rot. Bonds2

About N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide

N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide (PubChem CID 580065) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide
PubChem CID580065
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC NameN-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide
SMILESCC1(C)CC(NC(=O)c2ccn[nH]2)CC(C)(C)N1
InChIInChI=1S/C13H22N4O/c1-12(2)7-9(8-13(3,4)17-12)15-11(18)10-5-6-14-16-10/h5-6,9,17H,7-8H2,1-4H3,(H,14,16)(H,15,18)
InChIKeyKRCPLLRGUAVQQY-UHFFFAOYSA-N
XLogP1.45
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-sulfanylhexyl)-1H-pyrazole-5-carboxamide
CID 127026695
n-Methyl-1h-pyrazole-3-carboxamide
CID 19704574
N~3~-isobutyl-1H-pyrazole-3-carboxamide
CID 53017403
N~3~-isobutyl-1H-pyrazole-3-carboxamide
CID 53017403
2-[(3aR,7aR)-2-(1H-pyrazole-5-carbonyl)-3,3a,4,6,7,7a-hexahydro-1H-pyrrolo[3,4-c]pyridin-5-yl]-N-methylacetamide
CID 97402525
1-[2-(dimethylamino)ethyl]-8-(1H-pyrazole-5-carbonyl)-1,8-diazaspiro[5.5]undecan-2-one
CID 118744595
N-tert-Butyl-1H-pyrazole-5-carboxamide
CID 23279698
N-[(2S)-1-[[(1S)-1-cyano-2-[(3S)-2-oxopiperidin-3-yl]ethyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-1H-pyrazole-5-carboxamide
CID 162479487
N-(2-aminoethyl)-1H-pyrazole-5-carboxamide hydrochloride
CID 71758320
N-(2-aminoethyl)-1H-pyrazole-5-carboxamide hydrochloride
CID 71758320
N-(2-methylpentan-2-yl)-1H-pyrazole-3-carboxamide
CID 53538100

Frequently Asked Questions

What is the IUPAC name of N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide?
The IUPAC name of N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide (CID 580065) is N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide is CC1(C)CC(NC(=O)c2ccn[nH]2)CC(C)(C)N1.
What is the InChIKey of N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide?
The InChIKey is KRCPLLRGUAVQQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-12(2)7-9(8-13(3,4)17-12)15-11(18)10-5-6-14-16-10/h5-6,9,17H,7-8H2,1-4H3,(H,14,16)(H,15,18).
What are the key properties of N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide?
N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide has a molecular weight of 250.35 g/mol, XLogP of 1.45, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 580065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).