N-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide

C16H19N3O3 — CID 71838072

IUPACN-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cn3c(n2)CCCC3)cc1OC
InChIInChI=1S/C16H19N3O3/c1-21-13-7-6-11(9-14(13)22-2)17-16(20)12-10-19-8-4-3-5-15(19)18-12/h6-7,9-10H,3-5,8H2,1-2H3,(H,17,20)
InChIKeyIFZWALUVADMJNU-UHFFFAOYSA-N
MW301.35 g/mol
LogP2.49
Rot. Bonds4

About N-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide

N-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 71838072) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID71838072
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC NameN-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cn3c(n2)CCCC3)cc1OC
InChIInChI=1S/C16H19N3O3/c1-21-13-7-6-11(9-14(13)22-2)17-16(20)12-10-19-8-4-3-5-15(19)18-12/h6-7,9-10H,3-5,8H2,1-2H3,(H,17,20)
InChIKeyIFZWALUVADMJNU-UHFFFAOYSA-N
XLogP2.49
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3,4-dimethoxyphenyl)-3-[3-(1H-imidazol-1-yl)propyl]urea
CID 6539194
1-[4-[4-(Dimethylamino)butoxy]-3-methoxyphenyl]-3-[3-(5-methylimidazol-1-yl)propyl]-1-(1-methylpiperidin-4-yl)urea
CID 166631429
9-(3-methoxyphenyl)-1,7-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
CID 3936354
N-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide
CID 9267164
1-(3,4-Dimethoxyphenyl)-3-[3-(5-methylimidazol-1-yl)propyl]urea
CID 25015755
1-(3,4-Dimethoxyphenyl)-3-(3-(5-methyl-1H-imidazol-1-yl)propyl)thiourea
CID 25022550
(3-(5-Methyl-1H-imidazol-1-yl)propyl)-2-cyano-3-(2,3-dihydrobenzo[b][1,4]dioxin-7-yl)guanidine
CID 25054713
1-(3,4-Dimethoxyphenyl)-3-(3-(4-methyl-1H-imidazol-1-yl)propyl)thiourea
CID 25062649
N-[3-[2-methoxy-4-[3-(5-methylimidazol-1-yl)propylcarbamothioylamino]phenoxy]propyl]acetamide
CID 137639662
1-[(2-Amino-4-pyridinyl)methyl]-1-(3,4-dimethoxyphenyl)-3-[3-(5-methylimidazol-1-yl)propyl]urea
CID 155511970
1-(3,4-Dimethoxyphenyl)-1-ethyl-3-[3-(5-methylimidazol-1-yl)propyl]thiourea
CID 155514688
1-(3,4-Dimethoxyphenyl)-3-[3-(5-methylimidazol-1-yl)propyl]-1-phenylurea
CID 155514984

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide (CID 71838072) is N-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide is COc1ccc(NC(=O)c2cn3c(n2)CCCC3)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is IFZWALUVADMJNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c1-21-13-7-6-11(9-14(13)22-2)17-16(20)12-10-19-8-4-3-5-15(19)18-12/h6-7,9-10H,3-5,8H2,1-2H3,(H,17,20).
What are the key properties of N-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide?
N-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 301.35 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 71838072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).