N-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide

C14H18N4O2 — CID 99779011

IUPACN-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
SMILESO=C(NC[C@H]1CCCC[C@H]1O)c1cnn2ccncc12
InChIInChI=1S/C14H18N4O2/c19-13-4-2-1-3-10(13)7-16-14(20)11-8-17-18-6-5-15-9-12(11)18/h5-6,8-10,13,19H,1-4,7H2,(H,16,20)/t10-,13-/m1/s1
InChIKeyQJJVNYJMRFZSCD-ZWNOBZJWSA-N
MW274.32 g/mol
LogP1.01
Rot. Bonds3

About N-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide

N-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide (PubChem CID 99779011) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
PubChem CID99779011
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC NameN-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
SMILESO=C(NC[C@H]1CCCC[C@H]1O)c1cnn2ccncc12
InChIInChI=1S/C14H18N4O2/c19-13-4-2-1-3-10(13)7-16-14(20)11-8-17-18-6-5-15-9-12(11)18/h5-6,8-10,13,19H,1-4,7H2,(H,16,20)/t10-,13-/m1/s1
InChIKeyQJJVNYJMRFZSCD-ZWNOBZJWSA-N
XLogP1.01
TPSA79.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopentylpyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103119999
N-[(1R,2R)-2-aminocyclohexyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103121138
N-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103120602
N-(2-hydroxycyclohexyl)-N-methylpyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103120374
N-[(3R)-piperidin-3-yl]pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103121083
4-bromo-N-[[(1R,2S)-2-hydroxycyclopentyl]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 167928022
N-[[2-(chloromethyl)cyclopentyl]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103122654
N-(4-chlorobutyl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 106845452
N-(3-azabicyclo[3.1.0]hexan-6-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103120573
3-cyclopentyl-1-pyrazolo[1,5-a]pyrazin-3-ylpropan-1-one
CID 114192929
2-cyclobutyl-1-pyrazolo[1,5-a]pyrazin-3-ylethanone
CID 103124629
N-(2-carbamothioylcyclopentyl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103117980

Frequently Asked Questions

What is the IUPAC name of N-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
The IUPAC name of N-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide (CID 99779011) is N-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide.
What is the SMILES notation for N-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
The canonical SMILES for N-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide is O=C(NC[C@H]1CCCC[C@H]1O)c1cnn2ccncc12.
What is the InChIKey of N-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
The InChIKey is QJJVNYJMRFZSCD-ZWNOBZJWSA-N. The full InChI is InChI=1S/C14H18N4O2/c19-13-4-2-1-3-10(13)7-16-14(20)11-8-17-18-6-5-15-9-12(11)18/h5-6,8-10,13,19H,1-4,7H2,(H,16,20)/t10-,13-/m1/s1.
What are the key properties of N-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
N-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 1.01, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide is sourced from PubChem (CID 99779011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).