3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine

C11H17N3 — CID 155109534

IUPAC3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine
SMILESCC(C)C1=Nc2c(ncn2C)C(C)C1
InChIInChI=1S/C11H17N3/c1-7(2)9-5-8(3)10-11(13-9)14(4)6-12-10/h6-8H,5H2,1-4H3
InChIKeyPSCSFNLSUNEXJX-UHFFFAOYSA-N
MW191.28 g/mol
LogP2.66
Rot. Bonds1

About 3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine

3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine (PubChem CID 155109534) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine
PubChem CID155109534
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine
SMILESCC(C)C1=Nc2c(ncn2C)C(C)C1
InChIInChI=1S/C11H17N3/c1-7(2)9-5-8(3)10-11(13-9)14(4)6-12-10/h6-8H,5H2,1-4H3
InChIKeyPSCSFNLSUNEXJX-UHFFFAOYSA-N
XLogP2.66
TPSA30.18 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine?
The IUPAC name of 3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine (CID 155109534) is 3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine.
What is the SMILES notation for 3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine?
The canonical SMILES for 3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine is CC(C)C1=Nc2c(ncn2C)C(C)C1.
What is the InChIKey of 3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine?
The InChIKey is PSCSFNLSUNEXJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-7(2)9-5-8(3)10-11(13-9)14(4)6-12-10/h6-8H,5H2,1-4H3.
What are the key properties of 3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine?
3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine has a molecular weight of 191.28 g/mol, XLogP of 2.66, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine is sourced from PubChem (CID 155109534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).