N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine

C14H21N3O — CID 65049447

IUPACN-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine
SMILESCOCC(NCc1cn2ccccc2n1)C(C)C
InChIInChI=1S/C14H21N3O/c1-11(2)13(10-18-3)15-8-12-9-17-7-5-4-6-14(17)16-12/h4-7,9,11,13,15H,8,10H2,1-3H3
InChIKeyXVWSIWBQKGFURM-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.09
Rot. Bonds6

About N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine

N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine (PubChem CID 65049447) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine.

Molecular Properties

Compound NameN-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine
PubChem CID65049447
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC NameN-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine
SMILESCOCC(NCc1cn2ccccc2n1)C(C)C
InChIInChI=1S/C14H21N3O/c1-11(2)13(10-18-3)15-8-12-9-17-7-5-4-6-14(17)16-12/h4-7,9,11,13,15H,8,10H2,1-3H3
InChIKeyXVWSIWBQKGFURM-UHFFFAOYSA-N
XLogP2.09
TPSA38.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-ethoxy-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-methylbutan-2-amine
CID 103271206
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylpentan-3-amine
CID 61469725
2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol
CID 65313149
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-phenylpropan-2-amine
CID 63011096
(1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine
CID 81348736
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2,2-dimethoxyethanamine
CID 60687022
(1R)-1-(2-fluorophenyl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine
CID 81379921
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(5-methylfuran-2-yl)ethanamine
CID 54940366
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-(2-methoxyethoxy)propan-1-amine
CID 60698046
2-(imidazo[1,2-a]pyridin-2-ylmethylamino)-N-propylpropanamide
CID 60676900
(2R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-pyrazol-1-ylbutan-2-amine
CID 99705994
2-(imidazo[1,2-a]pyridin-2-ylmethylamino)-3-phenylpropan-1-ol
CID 63261332

Frequently Asked Questions

What is the IUPAC name of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine?
The IUPAC name of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine (CID 65049447) is N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine.
What is the SMILES notation for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine?
The canonical SMILES for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine is COCC(NCc1cn2ccccc2n1)C(C)C.
What is the InChIKey of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine?
The InChIKey is XVWSIWBQKGFURM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-11(2)13(10-18-3)15-8-12-9-17-7-5-4-6-14(17)16-12/h4-7,9,11,13,15H,8,10H2,1-3H3.
What are the key properties of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine?
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine has a molecular weight of 247.34 g/mol, XLogP of 2.09, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine is sourced from PubChem (CID 65049447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).