[2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine

C18H21N3 — CID 82223422

IUPAC[2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine
SMILESCC(C)c1ccc(Cc2cn3cc(CN)ccc3n2)cc1
InChIInChI=1S/C18H21N3/c1-13(2)16-6-3-14(4-7-16)9-17-12-21-11-15(10-19)5-8-18(21)20-17/h3-8,11-13H,9-10,19H2,1-2H3
InChIKeyQODUMOBOBNSGPV-UHFFFAOYSA-N
MW279.39 g/mol
LogP3.51
Rot. Bonds4

About [2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine

[2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine (PubChem CID 82223422) has the molecular formula C18H21N3 and a molecular weight of 279.39 g/mol. Its IUPAC name is [2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine.

Molecular Properties

Compound Name[2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine
PubChem CID82223422
Molecular FormulaC18H21N3
Molecular Weight279.39 g/mol
Exact Mass279.17
IUPAC Name[2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine
SMILESCC(C)c1ccc(Cc2cn3cc(CN)ccc3n2)cc1
InChIInChI=1S/C18H21N3/c1-13(2)16-6-3-14(4-7-16)9-17-12-21-11-15(10-19)5-8-18(21)20-17/h3-8,11-13H,9-10,19H2,1-2H3
InChIKeyQODUMOBOBNSGPV-UHFFFAOYSA-N
XLogP3.51
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-propan-2-ylphenyl)methyl]-N-propylimidazo[1,2-a]pyridin-6-amine
CID 94964023
[2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine
CID 82223496
2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 82223223
[2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-8-yl]methanamine
CID 82223420
[2-(furan-2-ylmethyl)imidazo[1,2-a]pyridin-6-yl]methanamine
CID 117130971
[2-[(2-methoxyphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine
CID 82223649
2-[(4-bromophenyl)methyl]-6-methylimidazo[1,2-a]pyridine
CID 117130599
[1-[(4-propan-2-ylphenyl)methyl]pyrrol-3-yl]methanamine
CID 66410364
[2-(4-ethylphenyl)imidazo[1,2-a]pyridin-6-yl]methanamine
CID 79021351
2-(2-propan-2-ylimidazo[1,2-a]pyridin-6-yl)ethanamine
CID 83832332
6-(aminomethyl)-N-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 167948650
[2-(1-propan-2-ylpiperidin-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine
CID 117129618

Frequently Asked Questions

What is the IUPAC name of [2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine?
The IUPAC name of [2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine (CID 82223422) is [2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine.
What is the SMILES notation for [2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine?
The canonical SMILES for [2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine is CC(C)c1ccc(Cc2cn3cc(CN)ccc3n2)cc1.
What is the InChIKey of [2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine?
The InChIKey is QODUMOBOBNSGPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3/c1-13(2)16-6-3-14(4-7-16)9-17-12-21-11-15(10-19)5-8-18(21)20-17/h3-8,11-13H,9-10,19H2,1-2H3.
What are the key properties of [2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine?
[2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine has a molecular weight of 279.39 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine is sourced from PubChem (CID 82223422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).