N-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine

C15H19N5 — CID 79985990

IUPACN-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine
SMILESCCNCCc1cn(Cc2cn3ccccc3n2)cn1
InChIInChI=1S/C15H19N5/c1-2-16-7-6-13-9-19(12-17-13)10-14-11-20-8-4-3-5-15(20)18-14/h3-5,8-9,11-12,16H,2,6-7,10H2,1H3
InChIKeyAFTPLEPKQUHSLS-UHFFFAOYSA-N
MW269.35 g/mol
LogP1.73
Rot. Bonds6

About N-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine

N-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine (PubChem CID 79985990) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is N-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine.

Molecular Properties

Compound NameN-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine
PubChem CID79985990
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC NameN-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine
SMILESCCNCCc1cn(Cc2cn3ccccc3n2)cn1
InChIInChI=1S/C15H19N5/c1-2-16-7-6-13-9-19(12-17-13)10-14-11-20-8-4-3-5-15(20)18-14/h3-5,8-9,11-12,16H,2,6-7,10H2,1H3
InChIKeyAFTPLEPKQUHSLS-UHFFFAOYSA-N
XLogP1.73
TPSA47.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]methyl]propan-2-amine
CID 106719446
1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazole-4-carbaldehyde
CID 106716817
N-ethyl-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)ethanamine
CID 62336853
N-ethyl-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrol-3-yl]propan-1-amine
CID 79109628
N-ethyl-2-[1-[[4-(trifluoromethyl)phenyl]methyl]imidazol-4-yl]ethanamine
CID 79971788
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylpropan-2-amine
CID 28586618
N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine
CID 4701920
1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrol-3-yl]-N,2-dimethylpropan-1-amine
CID 79109900
2-[1-[(3-chloro-4-fluorophenyl)methyl]imidazol-4-yl]-N-ethylethanamine
CID 103040932
N-ethyl-2-[1-(2-methylbutyl)imidazol-4-yl]ethanamine
CID 79984937
3-[[4-[2-(ethylamino)ethyl]imidazol-1-yl]methyl]-2-fluorobenzonitrile
CID 107119304
N-[[1-(imidazo[1,2-a]pyridin-2-ylmethyl)piperidin-2-yl]methyl]ethanamine
CID 62580932

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine?
The IUPAC name of N-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine (CID 79985990) is N-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine.
What is the SMILES notation for N-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine?
The canonical SMILES for N-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine is CCNCCc1cn(Cc2cn3ccccc3n2)cn1.
What is the InChIKey of N-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine?
The InChIKey is AFTPLEPKQUHSLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5/c1-2-16-7-6-13-9-19(12-17-13)10-14-11-20-8-4-3-5-15(20)18-14/h3-5,8-9,11-12,16H,2,6-7,10H2,1H3.
What are the key properties of N-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine?
N-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine has a molecular weight of 269.35 g/mol, XLogP of 1.73, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-4-yl]ethanamine is sourced from PubChem (CID 79985990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).