1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol

C14H21ClN4O — CID 103838801

IUPAC1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol
SMILESCN(C)CC(C)(O)CNCc1cn2cc(Cl)ccc2n1
InChIInChI=1S/C14H21ClN4O/c1-14(20,10-18(2)3)9-16-6-12-8-19-7-11(15)4-5-13(19)17-12/h4-5,7-8,16,20H,6,9-10H2,1-3H3
InChIKeyQDVJQZOTSGFPJS-UHFFFAOYSA-N
MW296.80 g/mol
LogP1.39
Rot. Bonds6

About 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol

1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol (PubChem CID 103838801) has the molecular formula C14H21ClN4O and a molecular weight of 296.80 g/mol. Its IUPAC name is 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol
PubChem CID103838801
Molecular FormulaC14H21ClN4O
Molecular Weight296.80 g/mol
Exact Mass296.14
IUPAC Name1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol
SMILESCN(C)CC(C)(O)CNCc1cn2cc(Cl)ccc2n1
InChIInChI=1S/C14H21ClN4O/c1-14(20,10-18(2)3)9-16-6-12-8-19-7-11(15)4-5-13(19)17-12/h4-5,7-8,16,20H,6,9-10H2,1-3H3
InChIKeyQDVJQZOTSGFPJS-UHFFFAOYSA-N
XLogP1.39
TPSA52.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.80
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol?
The IUPAC name of 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol (CID 103838801) is 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol.
What is the SMILES notation for 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol?
The canonical SMILES for 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol is CN(C)CC(C)(O)CNCc1cn2cc(Cl)ccc2n1.
What is the InChIKey of 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol?
The InChIKey is QDVJQZOTSGFPJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN4O/c1-14(20,10-18(2)3)9-16-6-12-8-19-7-11(15)4-5-13(19)17-12/h4-5,7-8,16,20H,6,9-10H2,1-3H3.
What are the key properties of 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol?
1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol has a molecular weight of 296.80 g/mol, XLogP of 1.39, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol is sourced from PubChem (CID 103838801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).