N-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine

C16H17FN4 — CID 103385595

IUPACN-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine
SMILESCC(Cc1ccc(F)cc1)Nc1nccc2c1ncn2C
InChIInChI=1S/C16H17FN4/c1-11(9-12-3-5-13(17)6-4-12)20-16-15-14(7-8-18-16)21(2)10-19-15/h3-8,10-11H,9H2,1-2H3,(H,18,20)
InChIKeyMDASRWQGEWIQAP-UHFFFAOYSA-N
MW284.34 g/mol
LogP3.15
Rot. Bonds4

About N-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine

N-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine (PubChem CID 103385595) has the molecular formula C16H17FN4 and a molecular weight of 284.34 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine
PubChem CID103385595
Molecular FormulaC16H17FN4
Molecular Weight284.34 g/mol
Exact Mass284.14
IUPAC NameN-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine
SMILESCC(Cc1ccc(F)cc1)Nc1nccc2c1ncn2C
InChIInChI=1S/C16H17FN4/c1-11(9-12-3-5-13(17)6-4-12)20-16-15-14(7-8-18-16)21(2)10-19-15/h3-8,10-11H,9H2,1-2H3,(H,18,20)
InChIKeyMDASRWQGEWIQAP-UHFFFAOYSA-N
XLogP3.15
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine?
The IUPAC name of N-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine (CID 103385595) is N-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine.
What is the SMILES notation for N-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine?
The canonical SMILES for N-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine is CC(Cc1ccc(F)cc1)Nc1nccc2c1ncn2C.
What is the InChIKey of N-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine?
The InChIKey is MDASRWQGEWIQAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN4/c1-11(9-12-3-5-13(17)6-4-12)20-16-15-14(7-8-18-16)21(2)10-19-15/h3-8,10-11H,9H2,1-2H3,(H,18,20).
What are the key properties of N-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine?
N-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine has a molecular weight of 284.34 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)propan-2-yl]-1-methylimidazo[4,5-c]pyridin-4-amine is sourced from PubChem (CID 103385595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).