(3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol

C14H25N3O — CID 114213614

IUPAC(3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol
SMILESCCn1nncc1C(O)C1(CC(C)C)CCCC1
InChIInChI=1S/C14H25N3O/c1-4-17-12(10-15-16-17)13(18)14(9-11(2)3)7-5-6-8-14/h10-11,13,18H,4-9H2,1-3H3
InChIKeyCVKSRBYDRLRPTE-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.94
Rot. Bonds5

About (3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol

(3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol (PubChem CID 114213614) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is (3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol.

Molecular Properties

Compound Name(3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol
PubChem CID114213614
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name(3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol
SMILESCCn1nncc1C(O)C1(CC(C)C)CCCC1
InChIInChI=1S/C14H25N3O/c1-4-17-12(10-15-16-17)13(18)14(9-11(2)3)7-5-6-8-14/h10-11,13,18H,4-9H2,1-3H3
InChIKeyCVKSRBYDRLRPTE-UHFFFAOYSA-N
XLogP2.94
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-ethyltriazol-4-yl)-(1-methoxycycloheptyl)methanol
CID 114213130
(1-ethyl-4-methoxypyrazol-5-yl)-[1-(2-methylpropyl)cyclopentyl]methanol
CID 115837173
(1-piperidin-1-ylcyclopentyl)-(3-propyltriazol-4-yl)methanol
CID 114686588
1-[3-[(1-methylcyclobutyl)methyl]triazol-4-yl]ethanol
CID 130601818
1-(3-ethyltriazol-4-yl)-3,5,5-trimethylhexan-1-ol
CID 114213613
N-[(4-chloro-1-ethylpyrazol-5-yl)-[1-(2-methylpropyl)cyclopentyl]methyl]ethanamine
CID 105040484
[1-(2-methylpropyl)cyclopentyl]-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
CID 106786567
(2,5-dibromo-4-methylphenyl)-[1-(2-methylpropyl)cyclopentyl]methanol
CID 81473141
1-(3-ethyltriazol-4-yl)-2,2-difluoropropan-1-amine
CID 130715109
cyclopentyl-(3-propyltriazol-4-yl)methanol
CID 114684940
2-(3-ethyltriazol-4-yl)propan-2-ol
CID 115012063
(2-chloro-4-fluoro-5-methylphenyl)-[1-(2-methylpropyl)cyclopentyl]methanol
CID 81045388

Frequently Asked Questions

What is the IUPAC name of (3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol?
The IUPAC name of (3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol (CID 114213614) is (3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol.
What is the SMILES notation for (3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol?
The canonical SMILES for (3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol is CCn1nncc1C(O)C1(CC(C)C)CCCC1.
What is the InChIKey of (3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol?
The InChIKey is CVKSRBYDRLRPTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-4-17-12(10-15-16-17)13(18)14(9-11(2)3)7-5-6-8-14/h10-11,13,18H,4-9H2,1-3H3.
What are the key properties of (3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol?
(3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol has a molecular weight of 251.37 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethyltriazol-4-yl)-[1-(2-methylpropyl)cyclopentyl]methanol is sourced from PubChem (CID 114213614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).