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

C12H20N2O3 — CID 114645508

IUPAC(1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol
SMILESCOc1cnn(C)c1C(O)C1(OC)CCCC1
InChIInChI=1S/C12H20N2O3/c1-14-10(9(16-2)8-13-14)11(15)12(17-3)6-4-5-7-12/h8,11,15H,4-7H2,1-3H3
InChIKeyBSHFJJKUYWPVKS-UHFFFAOYSA-N
MW240.30 g/mol
LogP1.42
Rot. Bonds4

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

(1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol (PubChem CID 114645508) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is (1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol.

Molecular Properties

Compound Name(1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol
PubChem CID114645508
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC Name(1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol
SMILESCOc1cnn(C)c1C(O)C1(OC)CCCC1
InChIInChI=1S/C12H20N2O3/c1-14-10(9(16-2)8-13-14)11(15)12(17-3)6-4-5-7-12/h8,11,15H,4-7H2,1-3H3
InChIKeyBSHFJJKUYWPVKS-UHFFFAOYSA-N
XLogP1.42
TPSA56.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(1-methoxy-3-methylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol
CID 114645881
(4-methoxy-1-methylpyrazol-5-yl)-(1-methylcyclopentyl)methanol
CID 115836869
1-[hydroxy-(4-methoxy-1-methylpyrazol-5-yl)methyl]cyclohexan-1-ol
CID 103451587
(1-methoxycycloheptyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine
CID 114662048
[1-(diethylamino)cyclopentyl]-(4-methoxy-1-methylpyrazol-5-yl)methanol
CID 114644530
N-[(1-methoxycyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]ethanamine
CID 114661820
N-[(1-methoxycyclobutyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]ethanamine
CID 114660947
(4-methoxy-1-methylpyrazol-5-yl)-(1-phenylcyclopropyl)methanol
CID 114643567
(1-methoxy-4,4-dimethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine
CID 114662029
(1-ethoxycyclohexyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114645814
(1-methoxy-3-methylcyclohexyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114645878
(1-methoxycycloheptyl)-(3-methyltriazol-4-yl)methanol
CID 114686842

Frequently Asked Questions

What is the IUPAC name of (1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol?
The IUPAC name of (1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol (CID 114645508) is (1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol.
What is the SMILES notation for (1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol?
The canonical SMILES for (1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol is COc1cnn(C)c1C(O)C1(OC)CCCC1.
What is the InChIKey of (1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol?
The InChIKey is BSHFJJKUYWPVKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3/c1-14-10(9(16-2)8-13-14)11(15)12(17-3)6-4-5-7-12/h8,11,15H,4-7H2,1-3H3.
What are the key properties of (1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol?
(1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol has a molecular weight of 240.30 g/mol, XLogP of 1.42, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol is sourced from PubChem (CID 114645508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).