2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide

C16H18ClN3O2 — CID 56743090

IUPAC2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide
SMILESCC(Oc1cccc(Cl)c1)C(=O)Nc1cnc2n1CCCC2
InChIInChI=1S/C16H18ClN3O2/c1-11(22-13-6-4-5-12(17)9-13)16(21)19-15-10-18-14-7-2-3-8-20(14)15/h4-6,9-11H,2-3,7-8H2,1H3,(H,19,21)
InChIKeyMFGXLNOABNKXJI-UHFFFAOYSA-N
MW319.79 g/mol
LogP3.28
Rot. Bonds4

About 2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide

2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide (PubChem CID 56743090) has the molecular formula C16H18ClN3O2 and a molecular weight of 319.79 g/mol. Its IUPAC name is 2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide.

Molecular Properties

Compound Name2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide
PubChem CID56743090
Molecular FormulaC16H18ClN3O2
Molecular Weight319.79 g/mol
Exact Mass319.11
IUPAC Name2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide
SMILESCC(Oc1cccc(Cl)c1)C(=O)Nc1cnc2n1CCCC2
InChIInChI=1S/C16H18ClN3O2/c1-11(22-13-6-4-5-12(17)9-13)16(21)19-15-10-18-14-7-2-3-8-20(14)15/h4-6,9-11H,2-3,7-8H2,1H3,(H,19,21)
InChIKeyMFGXLNOABNKXJI-UHFFFAOYSA-N
XLogP3.28
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.79
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-chlorophenoxy)-N-[2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)ethyl]propanamide
CID 51304479
(2R)-2-(3-chlorophenoxy)-N-(3-chlorophenyl)propanamide
CID 966245
(2S)-2-(3-chlorophenoxy)-N-(2-chlorophenyl)propanamide
CID 966242
2,4,6-trichloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide
CID 139013457
(2R)-2-(3-chlorophenoxy)-N-pyridin-2-ylpropanamide
CID 40533142
2-(3-chlorophenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide
CID 16566801
(2S)-2-(3-chlorophenoxy)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide
CID 36569893
(2R)-1-(azepan-1-yl)-2-(3-chlorophenoxy)propan-1-one
CID 897812
(2R)-2-(3-chlorophenoxy)-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide
CID 28575686
2-(3-chlorophenoxy)-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]propanamide
CID 55692123
(2S)-2-(3-methylphenoxy)-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]propanamide
CID 7941662
2-(3-chlorophenoxy)propanehydrazide
CID 2832641

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide?
The IUPAC name of 2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide (CID 56743090) is 2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide.
What is the SMILES notation for 2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide?
The canonical SMILES for 2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide is CC(Oc1cccc(Cl)c1)C(=O)Nc1cnc2n1CCCC2.
What is the InChIKey of 2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide?
The InChIKey is MFGXLNOABNKXJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClN3O2/c1-11(22-13-6-4-5-12(17)9-13)16(21)19-15-10-18-14-7-2-3-8-20(14)15/h4-6,9-11H,2-3,7-8H2,1H3,(H,19,21).
What are the key properties of 2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide?
2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide has a molecular weight of 319.79 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide is sourced from PubChem (CID 56743090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).