3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide

C17H22N4O — CID 71929127

IUPAC3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide
SMILESCc1cn2c(n1)C(CNCc1cccc(C(N)=O)c1)CCC2
InChIInChI=1S/C17H22N4O/c1-12-11-21-7-3-6-15(17(21)20-12)10-19-9-13-4-2-5-14(8-13)16(18)22/h2,4-5,8,11,15,19H,3,6-7,9-10H2,1H3,(H2,18,22)
InChIKeyFNGCBCBRIPVIDB-UHFFFAOYSA-N
MW298.39 g/mol
LogP1.96
Rot. Bonds5

About 3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide

3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide (PubChem CID 71929127) has the molecular formula C17H22N4O and a molecular weight of 298.39 g/mol. Its IUPAC name is 3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide.

Molecular Properties

Compound Name3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide
PubChem CID71929127
Molecular FormulaC17H22N4O
Molecular Weight298.39 g/mol
Exact Mass298.18
IUPAC Name3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide
SMILESCc1cn2c(n1)C(CNCc1cccc(C(N)=O)c1)CCC2
InChIInChI=1S/C17H22N4O/c1-12-11-21-7-3-6-15(17(21)20-12)10-19-9-13-4-2-5-14(8-13)16(18)22/h2,4-5,8,11,15,19H,3,6-7,9-10H2,1H3,(H2,18,22)
InChIKeyFNGCBCBRIPVIDB-UHFFFAOYSA-N
XLogP1.96
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide with MolForge

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Related Compounds

N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-[(8R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methanamine
CID 97217183
4-[3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]phenoxy]butanenitrile
CID 71929154
1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)-N-[(4-morpholin-4-ylphenyl)methyl]methanamine
CID 154749153
N-[(1-ethylbenzimidazol-2-yl)methyl]-1-[(8S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methanamine
CID 97060170
3-[[(1-methylpyrazol-4-yl)methylamino]methyl]benzamide
CID 43664759
3-[[[(2S)-4-methylmorpholin-2-yl]methylamino]methyl]benzamide
CID 95329722
3-[[[(2R,3S)-2-(1-methylpyrazol-4-yl)oxolan-3-yl]methylamino]methyl]benzamide
CID 97009863
3-[[(3-hydroxycyclohexyl)methylamino]methyl]benzamide
CID 103699975
3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide
CID 103270759
3-[(piperidin-3-ylmethylamino)methyl]benzamide
CID 80553685
3-[(thiolan-3-ylmethylamino)methyl]benzamide
CID 107131427
3-[[(1,1-dioxothiolan-3-yl)methylamino]methyl]benzamide
CID 55026135

Frequently Asked Questions

What is the IUPAC name of 3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide?
The IUPAC name of 3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide (CID 71929127) is 3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide.
What is the SMILES notation for 3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide?
The canonical SMILES for 3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide is Cc1cn2c(n1)C(CNCc1cccc(C(N)=O)c1)CCC2.
What is the InChIKey of 3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide?
The InChIKey is FNGCBCBRIPVIDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O/c1-12-11-21-7-3-6-15(17(21)20-12)10-19-9-13-4-2-5-14(8-13)16(18)22/h2,4-5,8,11,15,19H,3,6-7,9-10H2,1H3,(H2,18,22).
What are the key properties of 3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide?
3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide has a molecular weight of 298.39 g/mol, XLogP of 1.96, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methylamino]methyl]benzamide is sourced from PubChem (CID 71929127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).