2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol

C14H22N4O — CID 54879446

IUPAC2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol
SMILESCCCNCc1c(N(C)CCO)nc2ccccn12
InChIInChI=1S/C14H22N4O/c1-3-7-15-11-12-14(17(2)9-10-19)16-13-6-4-5-8-18(12)13/h4-6,8,15,19H,3,7,9-11H2,1-2H3
InChIKeyRKVIFHDZOFIPRQ-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.26
Rot. Bonds7

About 2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol

2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol (PubChem CID 54879446) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol.

Molecular Properties

Compound Name2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol
PubChem CID54879446
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol
SMILESCCCNCc1c(N(C)CCO)nc2ccccn12
InChIInChI=1S/C14H22N4O/c1-3-7-15-11-12-14(17(2)9-10-19)16-13-6-4-5-8-18(12)13/h4-6,8,15,19H,3,7,9-11H2,1-2H3
InChIKeyRKVIFHDZOFIPRQ-UHFFFAOYSA-N
XLogP1.26
TPSA52.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine
CID 43478478
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]acetamide
CID 43478504
2-[[3-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]ethanol
CID 60961309
3-(ethylaminomethyl)-N,N-dipropylimidazo[1,2-a]pyridin-2-amine
CID 43478234
[2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol
CID 43478072
N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine
CID 115591883
2-[[3-(ethylaminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]propan-1-ol
CID 104552885
N-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine
CID 43478259
3-(ethylaminomethyl)-N-methyl-N-(2-methylbutyl)imidazo[1,2-a]pyridin-2-amine
CID 43478486
2-[2-hydroxyethyl(methyl)amino]imidazo[1,2-a]pyridine-3-carbaldehyde
CID 60961424
3-(ethylaminomethyl)-N-methyl-N-(2-methylbutan-2-yl)imidazo[1,2-a]pyridin-2-amine
CID 63964208

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol?
The IUPAC name of 2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol (CID 54879446) is 2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol.
What is the SMILES notation for 2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol?
The canonical SMILES for 2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol is CCCNCc1c(N(C)CCO)nc2ccccn12.
What is the InChIKey of 2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol?
The InChIKey is RKVIFHDZOFIPRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-3-7-15-11-12-14(17(2)9-10-19)16-13-6-4-5-8-18(12)13/h4-6,8,15,19H,3,7,9-11H2,1-2H3.
What are the key properties of 2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol?
2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol has a molecular weight of 262.36 g/mol, XLogP of 1.26, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol is sourced from PubChem (CID 54879446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).