(4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol

C12H20N2O2 — CID 115836869

IUPAC(4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol
SMILESCOc1cnn(C)c1C(O)C1(C)CCCC1
InChIInChI=1S/C12H20N2O2/c1-12(6-4-5-7-12)11(15)10-9(16-3)8-13-14(10)2/h8,11,15H,4-7H2,1-3H3
InChIKeyKAQRYBQNHGFLAO-UHFFFAOYSA-N
MW224.30 g/mol
LogP2.04
Rot. Bonds3

About (4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol

(4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol (PubChem CID 115836869) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is (4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol.

Molecular Properties

Compound Name(4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol
PubChem CID115836869
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name(4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol
SMILESCOc1cnn(C)c1C(O)C1(C)CCCC1
InChIInChI=1S/C12H20N2O2/c1-12(6-4-5-7-12)11(15)10-9(16-3)8-13-14(10)2/h8,11,15H,4-7H2,1-3H3
InChIKeyKAQRYBQNHGFLAO-UHFFFAOYSA-N
XLogP2.04
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol
CID 114645508
1-[hydroxy-(4-methoxy-1-methylpyrazol-5-yl)methyl]cyclohexan-1-ol
CID 103451587
[1-(diethylamino)cyclopentyl]-(4-methoxy-1-methylpyrazol-5-yl)methanol
CID 114644530
(4-methoxy-1-methylpyrazol-5-yl)-(1-phenylcyclopropyl)methanol
CID 114643567
(1-methoxy-3-methylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol
CID 114645881
(1-methoxycycloheptyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine
CID 114662048
2,2-difluoro-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol
CID 114645393
2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol
CID 114643178
2-(1-methoxycyclobutyl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethanamine
CID 103559895
(4-methoxy-1-methylpyrazol-5-yl)-(2-methylthiolan-2-yl)methanamine
CID 105186271
1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methyl-1-(1-methylcyclopentyl)methanamine
CID 105048369
(1-methoxy-4,4-dimethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine
CID 114662029

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol?
The IUPAC name of (4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol (CID 115836869) is (4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol.
What is the SMILES notation for (4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol?
The canonical SMILES for (4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol is COc1cnn(C)c1C(O)C1(C)CCCC1.
What is the InChIKey of (4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol?
The InChIKey is KAQRYBQNHGFLAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-12(6-4-5-7-12)11(15)10-9(16-3)8-13-14(10)2/h8,11,15H,4-7H2,1-3H3.
What are the key properties of (4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol?
(4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol has a molecular weight of 224.30 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol is sourced from PubChem (CID 115836869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).