N-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide

C19H25N5O3 — CID 122693308

IUPACN-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide
SMILESCCc1cccc(NC(=O)c2cc(NC(=O)N3CCC(O)CC3)nn2C)c1
InChIInChI=1S/C19H25N5O3/c1-3-13-5-4-6-14(11-13)20-18(26)16-12-17(22-23(16)2)21-19(27)24-9-7-15(25)8-10-24/h4-6,11-12,15,25H,3,7-10H2,1-2H3,(H,20,26)(H,21,22,27)
InChIKeyATBDUCLCYZYKQI-UHFFFAOYSA-N
MW371.44 g/mol
LogP2.22
Rot. Bonds4

About N-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide

N-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide (PubChem CID 122693308) has the molecular formula C19H25N5O3 and a molecular weight of 371.44 g/mol. Its IUPAC name is N-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide
PubChem CID122693308
Molecular FormulaC19H25N5O3
Molecular Weight371.44 g/mol
Exact Mass371.20
IUPAC NameN-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide
SMILESCCc1cccc(NC(=O)c2cc(NC(=O)N3CCC(O)CC3)nn2C)c1
InChIInChI=1S/C19H25N5O3/c1-3-13-5-4-6-14(11-13)20-18(26)16-12-17(22-23(16)2)21-19(27)24-9-7-15(25)8-10-24/h4-6,11-12,15,25H,3,7-10H2,1-2H3,(H,20,26)(H,21,22,27)
InChIKeyATBDUCLCYZYKQI-UHFFFAOYSA-N
XLogP2.22
TPSA99.49 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 52.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-[(4-fluoro-3-methylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide
CID 122693286
N-(3-ethylphenyl)-3-hydroxypiperidine-1-carboxamide
CID 47032364
(3R)-3-hydroxy-N-[3-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-1-carboxamide
CID 111431314
N-(3-ethylphenyl)-4-(2-methoxyphenyl)piperidine-1-carboxamide
CID 23763777
N-(3-ethylphenyl)thiomorpholine-4-carboxamide
CID 3537953
3-[[3-[(4-hydroxypiperidine-1-carbonyl)amino]-1-methylpyrazol-5-yl]methoxymethylamino]benzoic acid
CID 145187825
3-ethyl-N-[3-(ethylaminomethyl)phenyl]-1-methylpyrazole-5-carboxamide
CID 66121147
N-[3-(aminomethyl)phenyl]-4-(1-hydroxyethyl)piperidine-1-carboxamide
CID 106836739
1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide
CID 26880034
N-[3-(aminomethyl)phenyl]-4-ethylpiperidine-1-carboxamide
CID 61421947
(9aS)-N-(3-ethylphenyl)-8-methyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazine-2-carboxamide
CID 98743883
N-(3-ethylphenyl)-3-pyrazol-1-ylpropanamide
CID 46339322

Frequently Asked Questions

What is the IUPAC name of N-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide?
The IUPAC name of N-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide (CID 122693308) is N-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide.
What is the SMILES notation for N-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide?
The canonical SMILES for N-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide is CCc1cccc(NC(=O)c2cc(NC(=O)N3CCC(O)CC3)nn2C)c1.
What is the InChIKey of N-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide?
The InChIKey is ATBDUCLCYZYKQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O3/c1-3-13-5-4-6-14(11-13)20-18(26)16-12-17(22-23(16)2)21-19(27)24-9-7-15(25)8-10-24/h4-6,11-12,15,25H,3,7-10H2,1-2H3,(H,20,26)(H,21,22,27).
What are the key properties of N-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide?
N-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide has a molecular weight of 371.44 g/mol, XLogP of 2.22, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(3-ethylphenyl)carbamoyl]-1-methylpyrazol-3-yl]-4-hydroxypiperidine-1-carboxamide is sourced from PubChem (CID 122693308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).