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

C14H20ClN3 — CID 115625717

IUPACN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine
SMILESCC(NCc1cn2cc(Cl)ccc2n1)C(C)(C)C
InChIInChI=1S/C14H20ClN3/c1-10(14(2,3)4)16-7-12-9-18-8-11(15)5-6-13(18)17-12/h5-6,8-10,16H,7H2,1-4H3
InChIKeyMHVBKJSZIRIZGL-UHFFFAOYSA-N
MW265.79 g/mol
LogP3.51
Rot. Bonds3

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

N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine (PubChem CID 115625717) has the molecular formula C14H20ClN3 and a molecular weight of 265.79 g/mol. Its IUPAC name is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine.

Molecular Properties

Compound NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine
PubChem CID115625717
Molecular FormulaC14H20ClN3
Molecular Weight265.79 g/mol
Exact Mass265.13
IUPAC NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine
SMILESCC(NCc1cn2cc(Cl)ccc2n1)C(C)(C)C
InChIInChI=1S/C14H20ClN3/c1-10(14(2,3)4)16-7-12-9-18-8-11(15)5-6-13(18)17-12/h5-6,8-10,16H,7H2,1-4H3
InChIKeyMHVBKJSZIRIZGL-UHFFFAOYSA-N
XLogP3.51
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.79
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine?
The IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine (CID 115625717) is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine.
What is the SMILES notation for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine?
The canonical SMILES for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine is CC(NCc1cn2cc(Cl)ccc2n1)C(C)(C)C.
What is the InChIKey of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine?
The InChIKey is MHVBKJSZIRIZGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN3/c1-10(14(2,3)4)16-7-12-9-18-8-11(15)5-6-13(18)17-12/h5-6,8-10,16H,7H2,1-4H3.
What are the key properties of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine?
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine has a molecular weight of 265.79 g/mol, XLogP of 3.51, 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-dimethylbutan-2-amine is sourced from PubChem (CID 115625717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).