2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine

C12H14N4O — CID 43261853

IUPAC2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine
SMILESNc1ccc(-n2ccnc2)nc1OCC1CC1
InChIInChI=1S/C12H14N4O/c13-10-3-4-11(16-6-5-14-8-16)15-12(10)17-7-9-1-2-9/h3-6,8-9H,1-2,7,13H2
InChIKeyZOIOXGMTLAGYQI-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.64
Rot. Bonds4

About 2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine

2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine (PubChem CID 43261853) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine
PubChem CID43261853
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine
SMILESNc1ccc(-n2ccnc2)nc1OCC1CC1
InChIInChI=1S/C12H14N4O/c13-10-3-4-11(16-6-5-14-8-16)15-12(10)17-7-9-1-2-9/h3-6,8-9H,1-2,7,13H2
InChIKeyZOIOXGMTLAGYQI-UHFFFAOYSA-N
XLogP1.64
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine?
The IUPAC name of 2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine (CID 43261853) is 2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine.
What is the SMILES notation for 2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine?
The canonical SMILES for 2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine is Nc1ccc(-n2ccnc2)nc1OCC1CC1.
What is the InChIKey of 2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine?
The InChIKey is ZOIOXGMTLAGYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c13-10-3-4-11(16-6-5-14-8-16)15-12(10)17-7-9-1-2-9/h3-6,8-9H,1-2,7,13H2.
What are the key properties of 2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine?
2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine has a molecular weight of 230.27 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-6-imidazol-1-ylpyridin-3-amine is sourced from PubChem (CID 43261853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).