2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine

C17H28N4 — CID 79665478

IUPAC2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine
SMILESCCCN(Cc1cn2cccc(C)c2n1)CC(C)(C)CN
InChIInChI=1S/C17H28N4/c1-5-8-20(13-17(3,4)12-18)10-15-11-21-9-6-7-14(2)16(21)19-15/h6-7,9,11H,5,8,10,12-13,18H2,1-4H3
InChIKeyDBASWFGBILSBKE-UHFFFAOYSA-N
MW288.44 g/mol
LogP2.84
Rot. Bonds7

About 2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine

2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine (PubChem CID 79665478) has the molecular formula C17H28N4 and a molecular weight of 288.44 g/mol. Its IUPAC name is 2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine.

Molecular Properties

Compound Name2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine
PubChem CID79665478
Molecular FormulaC17H28N4
Molecular Weight288.44 g/mol
Exact Mass288.23
IUPAC Name2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine
SMILESCCCN(Cc1cn2cccc(C)c2n1)CC(C)(C)CN
InChIInChI=1S/C17H28N4/c1-5-8-20(13-17(3,4)12-18)10-15-11-21-9-6-7-14(2)16(21)19-15/h6-7,9,11H,5,8,10,12-13,18H2,1-4H3
InChIKeyDBASWFGBILSBKE-UHFFFAOYSA-N
XLogP2.84
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine?
The IUPAC name of 2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine (CID 79665478) is 2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine.
What is the SMILES notation for 2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine?
The canonical SMILES for 2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine is CCCN(Cc1cn2cccc(C)c2n1)CC(C)(C)CN.
What is the InChIKey of 2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine?
The InChIKey is DBASWFGBILSBKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4/c1-5-8-20(13-17(3,4)12-18)10-15-11-21-9-6-7-14(2)16(21)19-15/h6-7,9,11H,5,8,10,12-13,18H2,1-4H3.
What are the key properties of 2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine?
2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine has a molecular weight of 288.44 g/mol, XLogP of 2.84, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine is sourced from PubChem (CID 79665478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).