5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine

C15H20N4O — CID 106000281

IUPAC5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine
SMILESNc1ccc(-c2cncn2CCC2CCCCO2)cn1
InChIInChI=1S/C15H20N4O/c16-15-5-4-12(9-18-15)14-10-17-11-19(14)7-6-13-3-1-2-8-20-13/h4-5,9-11,13H,1-3,6-8H2,(H2,16,18)
InChIKeyBWPZFUZMQXEXSU-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.49
Rot. Bonds4

About 5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine

5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine (PubChem CID 106000281) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine.

Molecular Properties

Compound Name5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine
PubChem CID106000281
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine
SMILESNc1ccc(-c2cncn2CCC2CCCCO2)cn1
InChIInChI=1S/C15H20N4O/c16-15-5-4-12(9-18-15)14-10-17-11-19(14)7-6-13-3-1-2-8-20-13/h4-5,9-11,13H,1-3,6-8H2,(H2,16,18)
InChIKeyBWPZFUZMQXEXSU-UHFFFAOYSA-N
XLogP2.49
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(3-octylimidazol-4-yl)pyridin-2-amine
CID 114721585
5-[3-[(4-ethylcyclohexyl)methyl]imidazol-4-yl]pyridin-2-amine
CID 114719455
5-[3-(4,4,4-trifluorobutyl)imidazol-4-yl]pyridin-2-amine
CID 114721619
1-[3-[2-(oxolan-2-yl)ethyl]imidazol-4-yl]ethanamine
CID 114705093
5-[3-(2-butoxyethyl)imidazol-4-yl]pyridin-2-amine
CID 114719509
5-(cyclohexylmethyl)pyridin-2-amine;5-(3-methylimidazol-4-yl)pyridin-2-amine
CID 162155296
4-[3-(2-cyclobutylethyl)imidazol-4-yl]pyridin-2-amine
CID 114722232
5-[3-[2-(2-methylprop-2-enoxy)ethyl]imidazol-4-yl]pyridin-2-amine
CID 114722630
5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine
CID 171770243
2-(4-chlorophenyl)-1-[2-(oxan-2-yl)ethyl]imidazole
CID 56865531
1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine
CID 65161520
3-[5-(6-amino-3-pyridinyl)imidazol-1-yl]-N-propylpropanamide
CID 114719410

Frequently Asked Questions

What is the IUPAC name of 5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine?
The IUPAC name of 5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine (CID 106000281) is 5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine.
What is the SMILES notation for 5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine?
The canonical SMILES for 5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine is Nc1ccc(-c2cncn2CCC2CCCCO2)cn1.
What is the InChIKey of 5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine?
The InChIKey is BWPZFUZMQXEXSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c16-15-5-4-12(9-18-15)14-10-17-11-19(14)7-6-13-3-1-2-8-20-13/h4-5,9-11,13H,1-3,6-8H2,(H2,16,18).
What are the key properties of 5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine?
5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine has a molecular weight of 272.35 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[2-(oxan-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine is sourced from PubChem (CID 106000281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).