3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine

C15H22N4 — CID 62219767

IUPAC3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine
SMILESCCCCn1c(CCC)nc(-c2cccnc2)c1N
InChIInChI=1S/C15H22N4/c1-3-5-10-19-13(7-4-2)18-14(15(19)16)12-8-6-9-17-11-12/h6,8-9,11H,3-5,7,10,16H2,1-2H3
InChIKeyLNQFTYJHTFVPGC-UHFFFAOYSA-N
MW258.37 g/mol
LogP3.28
Rot. Bonds6

About 3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine

3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine (PubChem CID 62219767) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is 3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine.

Molecular Properties

Compound Name3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine
PubChem CID62219767
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC Name3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine
SMILESCCCCn1c(CCC)nc(-c2cccnc2)c1N
InChIInChI=1S/C15H22N4/c1-3-5-10-19-13(7-4-2)18-14(15(19)16)12-8-6-9-17-11-12/h6,8-9,11H,3-5,7,10,16H2,1-2H3
InChIKeyLNQFTYJHTFVPGC-UHFFFAOYSA-N
XLogP3.28
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine?
The IUPAC name of 3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine (CID 62219767) is 3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine.
What is the SMILES notation for 3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine?
The canonical SMILES for 3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine is CCCCn1c(CCC)nc(-c2cccnc2)c1N.
What is the InChIKey of 3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine?
The InChIKey is LNQFTYJHTFVPGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-3-5-10-19-13(7-4-2)18-14(15(19)16)12-8-6-9-17-11-12/h6,8-9,11H,3-5,7,10,16H2,1-2H3.
What are the key properties of 3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine?
3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine has a molecular weight of 258.37 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine is sourced from PubChem (CID 62219767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).