2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol

C15H21N3O2 — CID 66132442

IUPAC2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol
SMILESCCCn1cncc1C(CO)Nc1ccccc1OC
InChIInChI=1S/C15H21N3O2/c1-3-8-18-11-16-9-14(18)13(10-19)17-12-6-4-5-7-15(12)20-2/h4-7,9,11,13,17,19H,3,8,10H2,1-2H3
InChIKeyDZJMUYVMKGXCPQ-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.45
Rot. Bonds7

About 2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol

2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol (PubChem CID 66132442) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol.

Molecular Properties

Compound Name2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol
PubChem CID66132442
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol
SMILESCCCn1cncc1C(CO)Nc1ccccc1OC
InChIInChI=1S/C15H21N3O2/c1-3-8-18-11-16-9-14(18)13(10-19)17-12-6-4-5-7-15(12)20-2/h4-7,9,11,13,17,19H,3,8,10H2,1-2H3
InChIKeyDZJMUYVMKGXCPQ-UHFFFAOYSA-N
XLogP2.45
TPSA59.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-bromoanilino)-2-(3-ethylimidazol-4-yl)ethanol
CID 66134961
2-(1,5-dimethylpyrazol-4-yl)-2-(2-methoxyanilino)ethanol
CID 79584117
2-methoxy-N-[(3-propylimidazol-4-yl)methyl]aniline
CID 66134768
2-(2-methoxyphenyl)-2-(2-methylanilino)ethanol
CID 61047526
2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol
CID 104793189
2-(2-methoxyanilino)-2-(3-propan-2-ylimidazol-4-yl)acetic acid
CID 66164809
2-(benzylamino)-2-(3-ethylimidazol-4-yl)ethanol
CID 66133933
2-phenyl-2-[(3-propylimidazol-4-yl)methylamino]ethanol
CID 66130986
N-[2-(2-methoxyphenyl)-1-(3-methylimidazol-4-yl)ethyl]propan-1-amine
CID 82903206
(5-fluoro-2-methoxyphenyl)-(3-propylimidazol-4-yl)methanol
CID 82769158
(2S)-2-(2-methoxyanilino)pentanoic acid
CID 40788460
methyl 3-(ethylamino)-3-(3-propylimidazol-4-yl)propanoate
CID 66131265

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol?
The IUPAC name of 2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol (CID 66132442) is 2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol.
What is the SMILES notation for 2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol?
The canonical SMILES for 2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol is CCCn1cncc1C(CO)Nc1ccccc1OC.
What is the InChIKey of 2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol?
The InChIKey is DZJMUYVMKGXCPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-3-8-18-11-16-9-14(18)13(10-19)17-12-6-4-5-7-15(12)20-2/h4-7,9,11,13,17,19H,3,8,10H2,1-2H3.
What are the key properties of 2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol?
2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol has a molecular weight of 275.35 g/mol, XLogP of 2.45, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyanilino)-2-(3-propylimidazol-4-yl)ethanol is sourced from PubChem (CID 66132442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).