N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine

C17H28N4 — CID 43478478

IUPACN-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine
SMILESCCCCCN(C)c1nc2ccccn2c1CNCCC
InChIInChI=1S/C17H28N4/c1-4-6-8-12-20(3)17-15(14-18-11-5-2)21-13-9-7-10-16(21)19-17/h7,9-10,13,18H,4-6,8,11-12,14H2,1-3H3
InChIKeyDOGKAPZXSHITRV-UHFFFAOYSA-N
MW288.44 g/mol
LogP3.46
Rot. Bonds9

About N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine

N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine (PubChem CID 43478478) has the molecular formula C17H28N4 and a molecular weight of 288.44 g/mol. Its IUPAC name is N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine
PubChem CID43478478
Molecular FormulaC17H28N4
Molecular Weight288.44 g/mol
Exact Mass288.23
IUPAC NameN-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine
SMILESCCCCCN(C)c1nc2ccccn2c1CNCCC
InChIInChI=1S/C17H28N4/c1-4-6-8-12-20(3)17-15(14-18-11-5-2)21-13-9-7-10-16(21)19-17/h7,9-10,13,18H,4-6,8,11-12,14H2,1-3H3
InChIKeyDOGKAPZXSHITRV-UHFFFAOYSA-N
XLogP3.46
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

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-(bromomethyl)-N-methyl-N-pentylimidazo[1,2-a]pyridin-2-amine
CID 107080119
N-butyl-N-methyl-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine
CID 43478259
2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]acetamide
CID 43478504
[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
3-(ethylaminomethyl)-N,N-dipropylimidazo[1,2-a]pyridin-2-amine
CID 43478234
N-butyl-N-methyl-5-(propylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 43476286
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
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 N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine?
The IUPAC name of N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine (CID 43478478) is N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine.
What is the SMILES notation for N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine?
The canonical SMILES for N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine is CCCCCN(C)c1nc2ccccn2c1CNCCC.
What is the InChIKey of N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine?
The InChIKey is DOGKAPZXSHITRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4/c1-4-6-8-12-20(3)17-15(14-18-11-5-2)21-13-9-7-10-16(21)19-17/h7,9-10,13,18H,4-6,8,11-12,14H2,1-3H3.
What are the key properties of N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine?
N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine has a molecular weight of 288.44 g/mol, XLogP of 3.46, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine is sourced from PubChem (CID 43478478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).