5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide

C19H25N3O3 — CID 97155422

IUPAC5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide
SMILESO=C(NC[C@@H](O)COc1ccccc1)c1cn[nH]c1C1CCCCC1
InChIInChI=1S/C19H25N3O3/c23-15(13-25-16-9-5-2-6-10-16)11-20-19(24)17-12-21-22-18(17)14-7-3-1-4-8-14/h2,5-6,9-10,12,14-15,23H,1,3-4,7-8,11,13H2,(H,20,24)(H,21,22)/t15-/m1/s1
InChIKeyOYVIADNPMLCJJA-OAHLLOKOSA-N
MW343.43 g/mol
LogP2.63
Rot. Bonds7

About 5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide

5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide (PubChem CID 97155422) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is 5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide
PubChem CID97155422
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide
SMILESO=C(NC[C@@H](O)COc1ccccc1)c1cn[nH]c1C1CCCCC1
InChIInChI=1S/C19H25N3O3/c23-15(13-25-16-9-5-2-6-10-16)11-20-19(24)17-12-21-22-18(17)14-7-3-1-4-8-14/h2,5-6,9-10,12,14-15,23H,1,3-4,7-8,11,13H2,(H,20,24)(H,21,22)/t15-/m1/s1
InChIKeyOYVIADNPMLCJJA-OAHLLOKOSA-N
XLogP2.63
TPSA87.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2S)-2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-5-cyclohexyl-1H-pyrazole-4-carboxamide
CID 97454957
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5-cyclohexyl-N-[2-(4-ethylpiperazin-1-yl)propyl]-1H-pyrazole-4-carboxamide
CID 86798225
5-cyclopropyl-N-[(2R)-3-[4-(3,4-dichlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]-1H-pyrazole-4-carboxamide
CID 71459762
5-cyclohexyl-N-[(2S,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]-1H-pyrazole-4-carboxamide
CID 99777998
2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]carbamoyl]benzoic acid
CID 2812098
5-cyclohexyl-N-(pyrazolo[1,5-a]pyrimidin-3-ylmethyl)-1H-pyrazole-4-carboxamide
CID 70774352
benzyl N-[(2R)-2-hydroxy-3-phenoxypropyl]carbamate
CID 102235547
5-cyclohexyl-N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-yl]-1H-pyrazole-4-carboxamide
CID 131914240
(5-cyclohexyl-1H-pyrazol-4-yl)-(1,3-dihydroisoindol-2-yl)methanone
CID 70732469
N-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethyl]-2-methylbenzamide
CID 70545546
(2R)-1-[[(2S)-2-hydroxy-3-phenoxypropyl]amino]-3-phenoxypropan-2-ol
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Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide (CID 97155422) is 5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide is O=C(NC[C@@H](O)COc1ccccc1)c1cn[nH]c1C1CCCCC1.
What is the InChIKey of 5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide?
The InChIKey is OYVIADNPMLCJJA-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H25N3O3/c23-15(13-25-16-9-5-2-6-10-16)11-20-19(24)17-12-21-22-18(17)14-7-3-1-4-8-14/h2,5-6,9-10,12,14-15,23H,1,3-4,7-8,11,13H2,(H,20,24)(H,21,22)/t15-/m1/s1.
What are the key properties of 5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide?
5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 2.63, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-N-[(2R)-2-hydroxy-3-phenoxypropyl]-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 97155422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).