[3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate

C19H25N5O3 — CID 155025402

IUPAC[3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate
SMILESCCCNC(=O)OC1CCC(c2cc(NC(=O)c3ccnc(C)c3)n[nH]2)C1
InChIInChI=1S/C19H25N5O3/c1-3-7-21-19(26)27-15-5-4-13(10-15)16-11-17(24-23-16)22-18(25)14-6-8-20-12(2)9-14/h6,8-9,11,13,15H,3-5,7,10H2,1-2H3,(H,21,26)(H2,22,23,24,25)
InChIKeyIAMWXFYSHDSPAV-UHFFFAOYSA-N
MW371.44 g/mol
LogP3.14
Rot. Bonds6

About [3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate

[3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate (PubChem CID 155025402) has the molecular formula C19H25N5O3 and a molecular weight of 371.44 g/mol. Its IUPAC name is [3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate.

Molecular Properties

Compound Name[3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate
PubChem CID155025402
Molecular FormulaC19H25N5O3
Molecular Weight371.44 g/mol
Exact Mass371.20
IUPAC Name[3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate
SMILESCCCNC(=O)OC1CCC(c2cc(NC(=O)c3ccnc(C)c3)n[nH]2)C1
InChIInChI=1S/C19H25N5O3/c1-3-7-21-19(26)27-15-5-4-13(10-15)16-11-17(24-23-16)22-18(25)14-6-8-20-12(2)9-14/h6,8-9,11,13,15H,3-5,7,10H2,1-2H3,(H,21,26)(H2,22,23,24,25)
InChIKeyIAMWXFYSHDSPAV-UHFFFAOYSA-N
XLogP3.14
TPSA109.00 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 53.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

[(1S,3R)-3-[3-[(2-methylpyrazole-3-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate
CID 154616406
[3-[3-[[2-(6-methoxy-3-pyridinyl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate
CID 155025557
[3-[3-[[2-(1,3-thiazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate
CID 155025436
[(1R,3S)-3-[3-[[2-(2-sulfamoylphenyl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate
CID 154616396
[3-[3-[[2-(1,3-benzothiazol-7-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate
CID 155025480
[(1S,3R)-3-[3-[[2-(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate
CID 154616595
[(1S,3R)-3-[3-[[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate
CID 154616734
[(1S,3R)-3-[3-[(2-propylpyrazole-3-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propan-2-ylcarbamate
CID 170952374
[(1R,3S)-3-[3-[[2-(5-methyl-1,3,4-thiadiazol-2-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl] N-[(2S)-butan-2-yl]carbamate
CID 154616740
[(1R,3S)-3-[3-[[2-(2-methyl-1,3-thiazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl] N-(2-methylbutyl)carbamate
CID 155025552
[3-[3-[[2-(2-methoxyethyl)pyrazole-3-carbonyl]amino]-1H-pyrazol-5-yl]cyclopentyl] N-tert-butylcarbamate
CID 155025571
[(1R,3S)-3-[3-[[2-(3-chloro-4-methyl-2-pyridinyl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl] N-(1-methylcyclopropyl)carbamate
CID 154616585

Frequently Asked Questions

What is the IUPAC name of [3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate?
The IUPAC name of [3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate (CID 155025402) is [3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate.
What is the SMILES notation for [3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate?
The canonical SMILES for [3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate is CCCNC(=O)OC1CCC(c2cc(NC(=O)c3ccnc(C)c3)n[nH]2)C1.
What is the InChIKey of [3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate?
The InChIKey is IAMWXFYSHDSPAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O3/c1-3-7-21-19(26)27-15-5-4-13(10-15)16-11-17(24-23-16)22-18(25)14-6-8-20-12(2)9-14/h6,8-9,11,13,15H,3-5,7,10H2,1-2H3,(H,21,26)(H2,22,23,24,25).
What are the key properties of [3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate?
[3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate has a molecular weight of 371.44 g/mol, XLogP of 3.14, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[3-[(2-methylpyridine-4-carbonyl)amino]-1H-pyrazol-5-yl]cyclopentyl] N-propylcarbamate is sourced from PubChem (CID 155025402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).