1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine

C16H18N4 — CID 79296071

IUPAC1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine
SMILESCC(C)c1ccc(Cn2c(N)nc3cnccc32)cc1
InChIInChI=1S/C16H18N4/c1-11(2)13-5-3-12(4-6-13)10-20-15-7-8-18-9-14(15)19-16(20)17/h3-9,11H,10H2,1-2H3,(H2,17,19)
InChIKeyNANJNZCCTXXCRB-UHFFFAOYSA-N
MW266.35 g/mol
LogP3.19
Rot. Bonds3

About 1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine

1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine (PubChem CID 79296071) has the molecular formula C16H18N4 and a molecular weight of 266.35 g/mol. Its IUPAC name is 1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine.

Molecular Properties

Compound Name1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine
PubChem CID79296071
Molecular FormulaC16H18N4
Molecular Weight266.35 g/mol
Exact Mass266.15
IUPAC Name1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine
SMILESCC(C)c1ccc(Cn2c(N)nc3cnccc32)cc1
InChIInChI=1S/C16H18N4/c1-11(2)13-5-3-12(4-6-13)10-20-15-7-8-18-9-14(15)19-16(20)17/h3-9,11H,10H2,1-2H3,(H2,17,19)
InChIKeyNANJNZCCTXXCRB-UHFFFAOYSA-N
XLogP3.19
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine?
The IUPAC name of 1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine (CID 79296071) is 1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine.
What is the SMILES notation for 1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine?
The canonical SMILES for 1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine is CC(C)c1ccc(Cn2c(N)nc3cnccc32)cc1.
What is the InChIKey of 1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine?
The InChIKey is NANJNZCCTXXCRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4/c1-11(2)13-5-3-12(4-6-13)10-20-15-7-8-18-9-14(15)19-16(20)17/h3-9,11H,10H2,1-2H3,(H2,17,19).
What are the key properties of 1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine?
1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine has a molecular weight of 266.35 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine is sourced from PubChem (CID 79296071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).