2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane

C19H18N4O — CID 162759628

IUPAC2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane
SMILESC1CC1.Nc1nc2ccc(-c3c[nH]c4ccccc34)cn2c1C=O
InChIInChI=1S/C16H12N4O.C3H6/c17-16-14(9-21)20-8-10(5-6-15(20)19-16)12-7-18-13-4-2-1-3-11(12)13;1-2-3-1/h1-9,18H,17H2;1-3H2
InChIKeyQVVMLYHALYZZIF-UHFFFAOYSA-N
MW318.38 g/mol
LogP4.05
Rot. Bonds2

About 2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane

2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane (PubChem CID 162759628) has the molecular formula C19H18N4O and a molecular weight of 318.38 g/mol. Its IUPAC name is 2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane.

Molecular Properties

Compound Name2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane
PubChem CID162759628
Molecular FormulaC19H18N4O
Molecular Weight318.38 g/mol
Exact Mass318.15
IUPAC Name2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane
SMILESC1CC1.Nc1nc2ccc(-c3c[nH]c4ccccc34)cn2c1C=O
InChIInChI=1S/C16H12N4O.C3H6/c17-16-14(9-21)20-8-10(5-6-15(20)19-16)12-7-18-13-4-2-1-3-11(12)13;1-2-3-1/h1-9,18H,17H2;1-3H2
InChIKeyQVVMLYHALYZZIF-UHFFFAOYSA-N
XLogP4.05
TPSA76.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-6-(5-chloro-1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane
CID 162759624
2-amino-6-isoquinolin-4-ylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 162759487
2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 162759387
3-[4-(1H-indol-3-yl)phenyl]-1H-indole
CID 175007681
3-(1-methylpyrazol-4-yl)-1H-indole
CID 118064780
2-methyl-6-phenylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 2759987
4-(1H-indol-3-yl)imidazole-1,2-diamine
CID 82284365
6-(1H-indol-3-yl)-1,3,5-triazine-2,4-diamine
CID 14358165
methane;3-phenyl-1H-indole
CID 167711687
3-(1-phenylpyrazol-4-yl)-1H-indole
CID 70687777
4-amino-5-(1H-indol-3-yl)-1H-pyrimidin-6-one
CID 135780355
3-pyridin-4-yl-1H-indole
CID 159430533

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane?
The IUPAC name of 2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane (CID 162759628) is 2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane.
What is the SMILES notation for 2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane?
The canonical SMILES for 2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane is C1CC1.Nc1nc2ccc(-c3c[nH]c4ccccc34)cn2c1C=O.
What is the InChIKey of 2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane?
The InChIKey is QVVMLYHALYZZIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4O.C3H6/c17-16-14(9-21)20-8-10(5-6-15(20)19-16)12-7-18-13-4-2-1-3-11(12)13;1-2-3-1/h1-9,18H,17H2;1-3H2.
What are the key properties of 2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane?
2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane has a molecular weight of 318.38 g/mol, XLogP of 4.05, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(1H-indol-3-yl)imidazo[1,2-a]pyridine-3-carbaldehyde;cyclopropane is sourced from PubChem (CID 162759628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).