N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide

C14H18ClN3O — CID 47150050

IUPACN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide
SMILESCC(C)(C)CC(=O)NCc1cn2cc(Cl)ccc2n1
InChIInChI=1S/C14H18ClN3O/c1-14(2,3)6-13(19)16-7-11-9-18-8-10(15)4-5-12(18)17-11/h4-5,8-9H,6-7H2,1-3H3,(H,16,19)
InChIKeyHNTZOAFQPKXNGH-UHFFFAOYSA-N
MW279.77 g/mol
LogP3.04
Rot. Bonds3

About N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide

N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide (PubChem CID 47150050) has the molecular formula C14H18ClN3O and a molecular weight of 279.77 g/mol. Its IUPAC name is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide.

Molecular Properties

Compound NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide
PubChem CID47150050
Molecular FormulaC14H18ClN3O
Molecular Weight279.77 g/mol
Exact Mass279.11
IUPAC NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide
SMILESCC(C)(C)CC(=O)NCc1cn2cc(Cl)ccc2n1
InChIInChI=1S/C14H18ClN3O/c1-14(2,3)6-13(19)16-7-11-9-18-8-10(15)4-5-12(18)17-11/h4-5,8-9H,6-7H2,1-3H3,(H,16,19)
InChIKeyHNTZOAFQPKXNGH-UHFFFAOYSA-N
XLogP3.04
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.77
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]hexanamide
CID 47151010
N-tert-butyl-3-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]propanamide
CID 115625685
N-[2-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-2-oxoethyl]-4-(trifluoromethyl)benzamide
CID 86920475
2-tert-butyl-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-thiazole-5-carboxamide
CID 47882821
1-(6-chloroimidazo[1,2-a]pyridin-2-yl)-N-[(2-methylpropan-2-yl)oxy]methanamine
CID 82723556
5-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-2-fluorobenzamide
CID 86917632
(2E,4E)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]hexa-2,4-dienamide
CID 47151007
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine
CID 115625717
3-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-N-methylpropanamide
CID 78998419
2-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-2-methylpentanoic acid
CID 43619667
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methoxy-2-methylpropan-2-amine
CID 113231286
2-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]ethylurea
CID 83112157

Frequently Asked Questions

What is the IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide?
The IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide (CID 47150050) is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide.
What is the SMILES notation for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide?
The canonical SMILES for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide is CC(C)(C)CC(=O)NCc1cn2cc(Cl)ccc2n1.
What is the InChIKey of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide?
The InChIKey is HNTZOAFQPKXNGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClN3O/c1-14(2,3)6-13(19)16-7-11-9-18-8-10(15)4-5-12(18)17-11/h4-5,8-9H,6-7H2,1-3H3,(H,16,19).
What are the key properties of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide?
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide has a molecular weight of 279.77 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide is sourced from PubChem (CID 47150050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).