3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine

C19H24N4O — CID 141110980

IUPAC3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine
SMILESCCn1cnc2c(-c3ccccc3)ncc(OCCCN(C)C)c21
InChIInChI=1S/C19H24N4O/c1-4-23-14-21-18-17(15-9-6-5-7-10-15)20-13-16(19(18)23)24-12-8-11-22(2)3/h5-7,9-10,13-14H,4,8,11-12H2,1-3H3
InChIKeyYIEOECOVCIQYHD-UHFFFAOYSA-N
MW324.43 g/mol
LogP3.45
Rot. Bonds7

About 3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine

3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine (PubChem CID 141110980) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is 3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine
PubChem CID141110980
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine
SMILESCCn1cnc2c(-c3ccccc3)ncc(OCCCN(C)C)c21
InChIInChI=1S/C19H24N4O/c1-4-23-14-21-18-17(15-9-6-5-7-10-15)20-13-16(19(18)23)24-12-8-11-22(2)3/h5-7,9-10,13-14H,4,8,11-12H2,1-3H3
InChIKeyYIEOECOVCIQYHD-UHFFFAOYSA-N
XLogP3.45
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine (CID 141110980) is 3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine is CCn1cnc2c(-c3ccccc3)ncc(OCCCN(C)C)c21.
What is the InChIKey of 3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine?
The InChIKey is YIEOECOVCIQYHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-4-23-14-21-18-17(15-9-6-5-7-10-15)20-13-16(19(18)23)24-12-8-11-22(2)3/h5-7,9-10,13-14H,4,8,11-12H2,1-3H3.
What are the key properties of 3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine?
3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine has a molecular weight of 324.43 g/mol, XLogP of 3.45, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethyl-4-phenylimidazo[4,5-c]pyridin-7-yl)oxy-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 141110980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).