2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide

C9H9ClN4 — CID 83884204

IUPAC2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide
SMILES[H]/N=C(\N)Cc1ccn2cnc(Cl)c2c1
InChIInChI=1S/C9H9ClN4/c10-9-7-3-6(4-8(11)12)1-2-14(7)5-13-9/h1-3,5H,4H2,(H3,11,12)
InChIKeyUEDXITUCZPWWJX-UHFFFAOYSA-N
MW208.65 g/mol
LogP1.47
Rot. Bonds2

About 2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide

2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide (PubChem CID 83884204) has the molecular formula C9H9ClN4 and a molecular weight of 208.65 g/mol. Its IUPAC name is 2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide.

Molecular Properties

Compound Name2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide
PubChem CID83884204
Molecular FormulaC9H9ClN4
Molecular Weight208.65 g/mol
Exact Mass208.05
IUPAC Name2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide
SMILES[H]/N=C(\N)Cc1ccn2cnc(Cl)c2c1
InChIInChI=1S/C9H9ClN4/c10-9-7-3-6(4-8(11)12)1-2-14(7)5-13-9/h1-3,5H,4H2,(H3,11,12)
InChIKeyUEDXITUCZPWWJX-UHFFFAOYSA-N
XLogP1.47
TPSA67.17 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.65
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-[4-(2-amino-2-iminoethyl)phenyl]ethanimidamide
CID 3685928
2-[2-(diethylamino)-4-pyridinyl]ethanimidamide
CID 83882972
2-pyridin-4-ylethanimidamide
CID 5078674
2-phenylethanimidamide
CID 27787
2-(3,4-diethoxyphenyl)ethanimidamide
CID 4071975
2-(7-chloro-1H-indol-5-yl)ethanimidamide
CID 83883547
2-(2,6-dichlorophenyl)ethanimidamide chloride
CID 45108783
2-[3-(2-aminoethyl)phenyl]ethanimidamide
CID 55252678
2-(6-methyl-3-pyridinyl)ethanimidamide
CID 83676272
2-[4-[(3-chloro-4-fluorophenyl)methoxy]phenyl]ethanimidamide
CID 103038181
2-(3-ethoxyphenyl)ethanimidamide
CID 4114058
2-(3-ethoxy-4-hydroxyphenyl)ethanimidamide
CID 91756255

Frequently Asked Questions

What is the IUPAC name of 2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide?
The IUPAC name of 2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide (CID 83884204) is 2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide.
What is the SMILES notation for 2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide?
The canonical SMILES for 2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide is [H]/N=C(\N)Cc1ccn2cnc(Cl)c2c1.
What is the InChIKey of 2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide?
The InChIKey is UEDXITUCZPWWJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClN4/c10-9-7-3-6(4-8(11)12)1-2-14(7)5-13-9/h1-3,5H,4H2,(H3,11,12).
What are the key properties of 2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide?
2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide has a molecular weight of 208.65 g/mol, XLogP of 1.47, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-chloroimidazo[1,5-a]pyridin-7-yl)ethanimidamide is sourced from PubChem (CID 83884204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).