N-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine

C16H26N4 — CID 43478259

IUPACN-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine
SMILESCCCCN(C)c1nc2ccccn2c1CNC(C)C
InChIInChI=1S/C16H26N4/c1-5-6-10-19(4)16-14(12-17-13(2)3)20-11-8-7-9-15(20)18-16/h7-9,11,13,17H,5-6,10,12H2,1-4H3
InChIKeyOOMUMWIXJWIZDR-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.07
Rot. Bonds7

About N-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine

N-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine (PubChem CID 43478259) has the molecular formula C16H26N4 and a molecular weight of 274.41 g/mol. Its IUPAC name is N-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine.

Molecular Properties

Compound NameN-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine
PubChem CID43478259
Molecular FormulaC16H26N4
Molecular Weight274.41 g/mol
Exact Mass274.22
IUPAC NameN-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine
SMILESCCCCN(C)c1nc2ccccn2c1CNC(C)C
InChIInChI=1S/C16H26N4/c1-5-6-10-19(4)16-14(12-17-13(2)3)20-11-8-7-9-15(20)18-16/h7-9,11,13,17H,5-6,10,12H2,1-4H3
InChIKeyOOMUMWIXJWIZDR-UHFFFAOYSA-N
XLogP3.07
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol
CID 43478072
N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine
CID 43478478
N-(cyclopropylmethyl)-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine
CID 60985016
N-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine
CID 43478462
3-(bromomethyl)-N-methyl-N-pentylimidazo[1,2-a]pyridin-2-amine
CID 107080119
N-(3-methoxypropyl)-N-methyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine
CID 63010016
2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol
CID 54879446
3-(ethylaminomethyl)-N,N-dipropylimidazo[1,2-a]pyridin-2-amine
CID 43478234
3-(ethylaminomethyl)-N-methyl-N-(2-methylbutyl)imidazo[1,2-a]pyridin-2-amine
CID 43478486
2-[[3-(ethylaminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]propan-1-ol
CID 104552885
N-[[2-(3-methylbutan-2-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-2-amine
CID 107761569
N'-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-2-yl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63784281

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine?
The IUPAC name of N-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine (CID 43478259) is N-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine.
What is the SMILES notation for N-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine?
The canonical SMILES for N-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine is CCCCN(C)c1nc2ccccn2c1CNC(C)C.
What is the InChIKey of N-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine?
The InChIKey is OOMUMWIXJWIZDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4/c1-5-6-10-19(4)16-14(12-17-13(2)3)20-11-8-7-9-15(20)18-16/h7-9,11,13,17H,5-6,10,12H2,1-4H3.
What are the key properties of N-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine?
N-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine has a molecular weight of 274.41 g/mol, XLogP of 3.07, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine is sourced from PubChem (CID 43478259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).