(5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol

C16H15N3O — CID 82199740

IUPAC(5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol
SMILESOCc1nnn(-c2cccc3ccccc23)c1C1CC1
InChIInChI=1S/C16H15N3O/c20-10-14-16(12-8-9-12)19(18-17-14)15-7-3-5-11-4-1-2-6-13(11)15/h1-7,12,20H,8-10H2
InChIKeyGYEUOQLEDYGVDR-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.79
Rot. Bonds3

About (5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol

(5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol (PubChem CID 82199740) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is (5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol.

Molecular Properties

Compound Name(5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol
PubChem CID82199740
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name(5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol
SMILESOCc1nnn(-c2cccc3ccccc23)c1C1CC1
InChIInChI=1S/C16H15N3O/c20-10-14-16(12-8-9-12)19(18-17-14)15-7-3-5-11-4-1-2-6-13(11)15/h1-7,12,20H,8-10H2
InChIKeyGYEUOQLEDYGVDR-UHFFFAOYSA-N
XLogP2.79
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-cyclopropyl-1-naphthalen-1-yltriazole-4-carbonitrile
CID 82199741
(1-naphthalen-1-yl-5-pyridin-3-yltriazol-4-yl)methanol
CID 82199759
[5-(4-butylcyclohexyl)-1-phenyltriazol-4-yl]methanol
CID 94939880
[1-(4-chloro-2-methylphenyl)-5-cyclobutyltriazol-4-yl]methanol
CID 82195237
5-[4-(hydroxymethyl)-5-phenyltriazol-1-yl]naphthalen-1-ol
CID 94938110
[5-cyclohexyl-1-(4-methoxyphenyl)triazol-4-yl]methanol
CID 82196201
[5-cyclopropyl-1-[4-(pyridin-4-ylmethyl)phenyl]triazol-4-yl]methanol
CID 94939958
[5-cyclopropyl-1-[(3-fluorophenyl)methyl]triazol-4-yl]methanol
CID 82211758
1-(1-naphthalen-1-yl-5-phenyltriazol-4-yl)ethanone
CID 94939684
5-[5-cyclobutyl-4-(hydroxymethyl)triazol-1-yl]benzene-1,3-dicarboxylic acid
CID 94935925
1-naphthalen-1-yl-5-phenyltriazole-4-carbaldehyde
CID 82199758
[1-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol;hydrochloride
CID 155821941

Frequently Asked Questions

What is the IUPAC name of (5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol?
The IUPAC name of (5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol (CID 82199740) is (5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol.
What is the SMILES notation for (5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol?
The canonical SMILES for (5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol is OCc1nnn(-c2cccc3ccccc23)c1C1CC1.
What is the InChIKey of (5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol?
The InChIKey is GYEUOQLEDYGVDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c20-10-14-16(12-8-9-12)19(18-17-14)15-7-3-5-11-4-1-2-6-13(11)15/h1-7,12,20H,8-10H2.
What are the key properties of (5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol?
(5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol has a molecular weight of 265.32 g/mol, XLogP of 2.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclopropyl-1-naphthalen-1-yltriazol-4-yl)methanol is sourced from PubChem (CID 82199740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).