(2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide

C19H20ClN3O3 — CID 93016814

IUPAC(2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide
SMILESCOc1ccc(-c2nc3cc(C)ccn3c2NC(=O)[C@@H](C)Cl)cc1OC
InChIInChI=1S/C19H20ClN3O3/c1-11-7-8-23-16(9-11)21-17(18(23)22-19(24)12(2)20)13-5-6-14(25-3)15(10-13)26-4/h5-10,12H,1-4H3,(H,22,24)/t12-/m1/s1
InChIKeyWBIMPWWSDVSYTE-GFCCVEGCSA-N
MW373.84 g/mol
LogP3.89
Rot. Bonds5

About (2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide

(2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide (PubChem CID 93016814) has the molecular formula C19H20ClN3O3 and a molecular weight of 373.84 g/mol. Its IUPAC name is (2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide.

Molecular Properties

Compound Name(2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide
PubChem CID93016814
Molecular FormulaC19H20ClN3O3
Molecular Weight373.84 g/mol
Exact Mass373.12
IUPAC Name(2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide
SMILESCOc1ccc(-c2nc3cc(C)ccn3c2NC(=O)[C@@H](C)Cl)cc1OC
InChIInChI=1S/C19H20ClN3O3/c1-11-7-8-23-16(9-11)21-17(18(23)22-19(24)12(2)20)13-5-6-14(25-3)15(10-13)26-4/h5-10,12H,1-4H3,(H,22,24)/t12-/m1/s1
InChIKeyWBIMPWWSDVSYTE-GFCCVEGCSA-N
XLogP3.89
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.84
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-chloro-N-[7-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide
CID 93016859
N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]cyclopentanecarboxamide
CID 42693785
2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide
CID 42693842
2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide
CID 42693936
2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine;hydrochloride
CID 117068595
(E)-3-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]prop-2-enoate
CID 7023668
3,5-dimethoxy-N-[2-(4-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]benzamide
CID 42693981
[4-[3-(cyclohexylamino)-7-methylimidazo[1,2-a]pyridin-2-yl]-2-methoxyphenyl] cyclopropanecarboxylate
CID 42743325
2-[2-(4-methoxy-3-methylphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanethioamide
CID 82030222
[2-methoxy-4-[7-methyl-3-(2,4,4-trimethylpentan-2-ylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 3,5-dichlorobenzoate
CID 42658980
ethyl N-[7-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]carbamate
CID 23938620
N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(2,3,4-trimethoxyphenyl)acetamide
CID 18281184

Frequently Asked Questions

What is the IUPAC name of (2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide?
The IUPAC name of (2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide (CID 93016814) is (2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide.
What is the SMILES notation for (2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide?
The canonical SMILES for (2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide is COc1ccc(-c2nc3cc(C)ccn3c2NC(=O)[C@@H](C)Cl)cc1OC.
What is the InChIKey of (2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide?
The InChIKey is WBIMPWWSDVSYTE-GFCCVEGCSA-N. The full InChI is InChI=1S/C19H20ClN3O3/c1-11-7-8-23-16(9-11)21-17(18(23)22-19(24)12(2)20)13-5-6-14(25-3)15(10-13)26-4/h5-10,12H,1-4H3,(H,22,24)/t12-/m1/s1.
What are the key properties of (2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide?
(2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide has a molecular weight of 373.84 g/mol, XLogP of 3.89, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide is sourced from PubChem (CID 93016814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).