(1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol

C17H22N2O — CID 63975228

IUPAC(1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol
SMILESCCCn1ccnc1C(O)C1CCCc2ccccc21
InChIInChI=1S/C17H22N2O/c1-2-11-19-12-10-18-17(19)16(20)15-9-5-7-13-6-3-4-8-14(13)15/h3-4,6,8,10,12,15-16,20H,2,5,7,9,11H2,1H3
InChIKeyCSDXVKKXEKEXDK-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.45
Rot. Bonds4

About (1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol

(1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol (PubChem CID 63975228) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is (1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol.

Molecular Properties

Compound Name(1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol
PubChem CID63975228
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name(1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol
SMILESCCCn1ccnc1C(O)C1CCCc2ccccc21
InChIInChI=1S/C17H22N2O/c1-2-11-19-12-10-18-17(19)16(20)15-9-5-7-13-6-3-4-8-14(13)15/h3-4,6,8,10,12,15-16,20H,2,5,7,9,11H2,1H3
InChIKeyCSDXVKKXEKEXDK-UHFFFAOYSA-N
XLogP3.45
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-methylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]propan-1-amine
CID 63974331
2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 79751984
2,3-dihydro-1H-inden-1-yl-(1-ethylimidazol-2-yl)methanamine
CID 65403570
N-[7-bicyclo[4.2.0]octa-1,3,5-trienyl-(1-propylimidazol-2-yl)methyl]propan-1-amine
CID 64984371
1-(2,3-dihydro-1H-inden-1-yl)-2-(1-propylimidazol-2-yl)ethanone
CID 79744199
(4-ethylcyclohexyl)-(1-propylimidazol-2-yl)methanol
CID 65393927
3-bicyclo[3.1.0]hexanyl-(1-propylimidazol-2-yl)methanol
CID 115799261
1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
CID 63247593
1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-2-(1-ethylimidazol-2-yl)ethanol
CID 79752863
(4-chloro-1-propylpyrazol-5-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 114651447
(3-methyloxolan-2-yl)-(1-propylimidazol-2-yl)methanol
CID 115799314
3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol
CID 82920616

Frequently Asked Questions

What is the IUPAC name of (1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol?
The IUPAC name of (1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol (CID 63975228) is (1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol.
What is the SMILES notation for (1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol?
The canonical SMILES for (1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol is CCCn1ccnc1C(O)C1CCCc2ccccc21.
What is the InChIKey of (1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol?
The InChIKey is CSDXVKKXEKEXDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-2-11-19-12-10-18-17(19)16(20)15-9-5-7-13-6-3-4-8-14(13)15/h3-4,6,8,10,12,15-16,20H,2,5,7,9,11H2,1H3.
What are the key properties of (1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol?
(1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol has a molecular weight of 270.38 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol is sourced from PubChem (CID 63975228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).