N-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide

C19H25N5O2 — CID 135892055

IUPACN-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide
SMILESCCc1cc(=O)[nH]c(-n2nc(C3CC3)cc2NC(=O)C2CCCCC2)n1
InChIInChI=1S/C19H25N5O2/c1-2-14-10-17(25)22-19(20-14)24-16(11-15(23-24)12-8-9-12)21-18(26)13-6-4-3-5-7-13/h10-13H,2-9H2,1H3,(H,21,26)(H,20,22,25)
InChIKeyDLAOQPFKEFZRBA-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.91
Rot. Bonds5

About N-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide

N-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide (PubChem CID 135892055) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide
PubChem CID135892055
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC NameN-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide
SMILESCCc1cc(=O)[nH]c(-n2nc(C3CC3)cc2NC(=O)C2CCCCC2)n1
InChIInChI=1S/C19H25N5O2/c1-2-14-10-17(25)22-19(20-14)24-16(11-15(23-24)12-8-9-12)21-18(26)13-6-4-3-5-7-13/h10-13H,2-9H2,1H3,(H,21,26)(H,20,22,25)
InChIKeyDLAOQPFKEFZRBA-UHFFFAOYSA-N
XLogP2.91
TPSA92.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-methyl-2-(4-oxo-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-yl)pyrazol-3-yl]cyclohexanecarboxamide
CID 135551798
2-cyclohexyl-N-(3-methyl-1-(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)-1H-pyrazol-5-yl)acetamide
CID 135551800
N-[5-methyl-2-(6-oxo-4-propyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-phenylbutanamide
CID 135731891
N-[3-methyl-1-(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)-1H-pyrazol-5-yl]-3,3-diphenylpropanamide
CID 135731893
N-[1-(5-ethyl-4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-methyl-1H-pyrazol-5-yl]-3,3-diphenylpropanamide
CID 135857470
N-(1-(5-ethyl-4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-methyl-1H-pyrazol-5-yl)-3-phenylpropanamide
CID 135857471
N-(1-(5-ethyl-4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-methyl-1H-pyrazol-5-yl)-2-phenylbutanamide
CID 135857472
N-[1-(4-ethyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-methyl-1H-pyrazol-5-yl]-3,3-diphenylpropanamide
CID 135857473
2-(5-amino-3-cyclopropyl-1H-pyrazol-1-yl)-6-isopropylpyrimidin-4(3H)-one
CID 135984534
N-(3-cyclopropyl-1-(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)-1H-pyrazol-5-yl)-3-methylbutanamide
CID 136253212
N-(3-cyclopropyl-1-(4-oxo-3,4,5,6,7,8-hexahydroqui
CID 136253213
3-cyclopropyl-N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide
CID 168282664

Frequently Asked Questions

What is the IUPAC name of N-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide?
The IUPAC name of N-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide (CID 135892055) is N-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide.
What is the SMILES notation for N-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide?
The canonical SMILES for N-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide is CCc1cc(=O)[nH]c(-n2nc(C3CC3)cc2NC(=O)C2CCCCC2)n1.
What is the InChIKey of N-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide?
The InChIKey is DLAOQPFKEFZRBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-2-14-10-17(25)22-19(20-14)24-16(11-15(23-24)12-8-9-12)21-18(26)13-6-4-3-5-7-13/h10-13H,2-9H2,1H3,(H,21,26)(H,20,22,25).
What are the key properties of N-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide?
N-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide has a molecular weight of 355.44 g/mol, XLogP of 2.91, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-cyclopropyl-1-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-5-yl]cyclohexanecarboxamide is sourced from PubChem (CID 135892055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).