tert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate

C19H21N3O2 — CID 175306900

IUPACtert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate
SMILESCC(C)(C)OC(=O)NCc1cn2ccc(-c3ccccc3)cc2n1
InChIInChI=1S/C19H21N3O2/c1-19(2,3)24-18(23)20-12-16-13-22-10-9-15(11-17(22)21-16)14-7-5-4-6-8-14/h4-11,13H,12H2,1-3H3,(H,20,23)
InChIKeyDZJUXEROQPZUMJ-UHFFFAOYSA-N
MW323.40 g/mol
LogP4.03
Rot. Bonds3

About tert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate

tert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate (PubChem CID 175306900) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is tert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate
PubChem CID175306900
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Nametert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate
SMILESCC(C)(C)OC(=O)NCc1cn2ccc(-c3ccccc3)cc2n1
InChIInChI=1S/C19H21N3O2/c1-19(2,3)24-18(23)20-12-16-13-22-10-9-15(11-17(22)21-16)14-7-5-4-6-8-14/h4-11,13H,12H2,1-3H3,(H,20,23)
InChIKeyDZJUXEROQPZUMJ-UHFFFAOYSA-N
XLogP4.03
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-[(6-formylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate
CID 155167684
tert-butyl N-[(6-methyl-2-pyridinyl)methyl]carbamate
CID 63788697
tert-butyl N-[4-(imidazo[1,2-a]pyridin-2-ylmethylcarbamoyl)phenyl]carbamate
CID 9185284
tert-butyl N-[[3-[3-(aminomethyl)phenyl]phenyl]methyl]carbamate
CID 110282100
tert-butyl N-[(1-ethylpyrazol-3-yl)methyl]carbamate
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tert-butyl N-[[6-(chloromethyl)-2-pyridinyl]methyl]carbamate
CID 131092103
tert-butyl N-[(6-prop-2-enyl-2-pyridinyl)methyl]carbamate
CID 86618645
4-[2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-pyridinyl]benzoic acid
CID 18617692
tert-butyl N-([1,2,4]triazolo[4,3-a]pyridin-7-ylmethyl)carbamate
CID 119020406
tert-butyl N-[(3-fluoro-5-phenylphenyl)methyl]carbamate
CID 151221756
tert-butyl N-[[4-(phenoxymethyl)-2-pyridinyl]methyl]carbamate
CID 156818686
tert-butyl N-[[2-[4-(hydroxymethyl)phenyl]imidazo[1,2-a]pyrimidin-7-yl]methyl]carbamate
CID 122483314

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate?
The IUPAC name of tert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate (CID 175306900) is tert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate.
What is the SMILES notation for tert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate?
The canonical SMILES for tert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate is CC(C)(C)OC(=O)NCc1cn2ccc(-c3ccccc3)cc2n1.
What is the InChIKey of tert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate?
The InChIKey is DZJUXEROQPZUMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-19(2,3)24-18(23)20-12-16-13-22-10-9-15(11-17(22)21-16)14-7-5-4-6-8-14/h4-11,13H,12H2,1-3H3,(H,20,23).
What are the key properties of tert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate?
tert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate has a molecular weight of 323.40 g/mol, XLogP of 4.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[(7-phenylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate is sourced from PubChem (CID 175306900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).