N-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine

C14H18N4O — CID 104872076

IUPACN-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
SMILESCOC1CC(Nc2cccnc2-n2ccnc2C)C1
InChIInChI=1S/C14H18N4O/c1-10-15-6-7-18(10)14-13(4-3-5-16-14)17-11-8-12(9-11)19-2/h3-7,11-12,17H,8-9H2,1-2H3
InChIKeyLILUUOLLXXNKJE-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.17
Rot. Bonds4

About N-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine

N-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine (PubChem CID 104872076) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine.

Molecular Properties

Compound NameN-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
PubChem CID104872076
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC NameN-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
SMILESCOC1CC(Nc2cccnc2-n2ccnc2C)C1
InChIInChI=1S/C14H18N4O/c1-10-15-6-7-18(10)14-13(4-3-5-16-14)17-11-8-12(9-11)19-2/h3-7,11-12,17H,8-9H2,1-2H3
InChIKeyLILUUOLLXXNKJE-UHFFFAOYSA-N
XLogP2.17
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-methoxycyclohexyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 106871952
N-cyclopropyl-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 103439170
N-(cyclopropylmethyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 54863456
N-(3-methoxycyclobutyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine
CID 106821421
N-(dicyclopropylmethyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 60945201
2-(cyclopropylamino)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
CID 60927836
2-methoxy-N-(3-methoxycyclohexyl)pyridin-3-amine
CID 106871796
N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
CID 47254863
N-heptyl-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 60945336
N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]ethanesulfonamide
CID 64584172
N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 60943379
N-(3-ethoxycyclobutyl)-2-pyrrolidin-1-ylpyridin-3-amine
CID 112568481

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine?
The IUPAC name of N-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine (CID 104872076) is N-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine.
What is the SMILES notation for N-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine?
The canonical SMILES for N-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine is COC1CC(Nc2cccnc2-n2ccnc2C)C1.
What is the InChIKey of N-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine?
The InChIKey is LILUUOLLXXNKJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-10-15-6-7-18(10)14-13(4-3-5-16-14)17-11-8-12(9-11)19-2/h3-7,11-12,17H,8-9H2,1-2H3.
What are the key properties of N-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine?
N-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine has a molecular weight of 258.32 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxycyclobutyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine is sourced from PubChem (CID 104872076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).