N-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide

C19H34N4O — CID 46988576

IUPACN-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
SMILESCCCCn1ncc(C)c1NC(=O)CC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C19H34N4O/c1-7-8-9-23-17(14(2)13-20-23)21-16(24)10-15-11-18(3,4)22-19(5,6)12-15/h13,15,22H,7-12H2,1-6H3,(H,21,24)
InChIKeyCNWOVBJRVIQTCA-UHFFFAOYSA-N
MW334.51 g/mol
LogP3.88
Rot. Bonds6

About N-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide

N-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide (PubChem CID 46988576) has the molecular formula C19H34N4O and a molecular weight of 334.51 g/mol. Its IUPAC name is N-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
PubChem CID46988576
Molecular FormulaC19H34N4O
Molecular Weight334.51 g/mol
Exact Mass334.27
IUPAC NameN-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
SMILESCCCCn1ncc(C)c1NC(=O)CC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C19H34N4O/c1-7-8-9-23-17(14(2)13-20-23)21-16(24)10-15-11-18(3,4)22-19(5,6)12-15/h13,15,22H,7-12H2,1-6H3,(H,21,24)
InChIKeyCNWOVBJRVIQTCA-UHFFFAOYSA-N
XLogP3.88
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.51
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-{1-[(1-isopropyl-1H-pyrazol-4-yl)methyl]-4-piperidinyl}-1H-pyrazol-5-yl)cyclopentanecarboxamide
CID 24794235
2-cyclobutyl-N-[[5-[(2-cyclobutylacetyl)amino]-1-methylpyrazol-4-yl]methyl]acetamide
CID 71921233
N-[4-(aminomethyl)-1-methylpyrazol-3-yl]-4,4-difluorocyclohexane-1-carboxamide
CID 104592707
N-[4-(aminomethyl)-1-methylpyrazol-3-yl]-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 104592859
4,4-difluoro-N-[4-(N'-hydroxycarbamimidoyl)-1-methylpyrazol-5-yl]cyclohexane-1-carboxamide
CID 136321808
2-[(2-cyclohexylacetyl)amino]-N-[1-(cyclopropylmethyl)-4-methylpyrazol-5-yl]propanamide
CID 53623963
N-[1-(1-cyclopropylethyl)-4-methyl-1H-pyrazol-5-yl]-N'-[2-(2-oxopiperidin-1-yl)ethyl]urea
CID 118768286
1-ethyl-4-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 135783971
(2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide
CID 141479982
(2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide;hydrochloride
CID 141479994
5-(2-Methylheptanoylamino)-1-propan-2-ylpyrazole-4-carboxamide
CID 170775869
N-(1,4-dimethylpyrazol-5-yl)-2-[(2R)-1-methylpiperidin-2-yl]acetamide
CID 39794123

Frequently Asked Questions

What is the IUPAC name of N-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The IUPAC name of N-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide (CID 46988576) is N-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The canonical SMILES for N-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide is CCCCn1ncc(C)c1NC(=O)CC1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The InChIKey is CNWOVBJRVIQTCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N4O/c1-7-8-9-23-17(14(2)13-20-23)21-16(24)10-15-11-18(3,4)22-19(5,6)12-15/h13,15,22H,7-12H2,1-6H3,(H,21,24).
What are the key properties of N-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
N-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide has a molecular weight of 334.51 g/mol, XLogP of 3.88, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-butyl-4-methylpyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide is sourced from PubChem (CID 46988576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).