1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea

C14H17ClN4O — CID 47221365

IUPAC1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea
SMILESCC(NC(=O)NCc1cn2cc(Cl)ccc2n1)C1CC1
InChIInChI=1S/C14H17ClN4O/c1-9(10-2-3-10)17-14(20)16-6-12-8-19-7-11(15)4-5-13(19)18-12/h4-5,7-10H,2-3,6H2,1H3,(H2,16,17,20)
InChIKeyTXXIPZZKIWHKKL-UHFFFAOYSA-N
MW292.77 g/mol
LogP2.59
Rot. Bonds4

About 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea

1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea (PubChem CID 47221365) has the molecular formula C14H17ClN4O and a molecular weight of 292.77 g/mol. Its IUPAC name is 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea.

Molecular Properties

Compound Name1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea
PubChem CID47221365
Molecular FormulaC14H17ClN4O
Molecular Weight292.77 g/mol
Exact Mass292.11
IUPAC Name1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea
SMILESCC(NC(=O)NCc1cn2cc(Cl)ccc2n1)C1CC1
InChIInChI=1S/C14H17ClN4O/c1-9(10-2-3-10)17-14(20)16-6-12-8-19-7-11(15)4-5-13(19)18-12/h4-5,7-10H,2-3,6H2,1H3,(H2,16,17,20)
InChIKeyTXXIPZZKIWHKKL-UHFFFAOYSA-N
XLogP2.59
TPSA58.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.77
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-cyclopentylethanamine
CID 115345173
1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-[1-[4-(trifluoromethyl)phenyl]ethyl]urea
CID 86995183
1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-[1-[4-(2-methoxyethylsulfanyl)phenyl]ethyl]urea
CID 86889686
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide
CID 47150050
2-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-N,N-dimethylpropanamide
CID 78959550
1-(6-chloroimidazo[1,2-a]pyridin-2-yl)-N-[(1-propan-2-ylcyclopropyl)methyl]methanamine
CID 103743352
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]hexanamide
CID 47151010
1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(cyclobutylmethyl)-2-methylguanidine;hydroiodide
CID 119151426
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-N',3-dimethylpiperidine-1-carboximidamide;hydroiodide
CID 119130101
5-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-2-fluorobenzamide
CID 86917632
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-4-methylcyclohexan-1-amine
CID 78912858
2-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]ethylurea
CID 83112157

Frequently Asked Questions

What is the IUPAC name of 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea?
The IUPAC name of 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea (CID 47221365) is 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea.
What is the SMILES notation for 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea?
The canonical SMILES for 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea is CC(NC(=O)NCc1cn2cc(Cl)ccc2n1)C1CC1.
What is the InChIKey of 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea?
The InChIKey is TXXIPZZKIWHKKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN4O/c1-9(10-2-3-10)17-14(20)16-6-12-8-19-7-11(15)4-5-13(19)18-12/h4-5,7-10H,2-3,6H2,1H3,(H2,16,17,20).
What are the key properties of 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea?
1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea has a molecular weight of 292.77 g/mol, XLogP of 2.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(1-cyclopropylethyl)urea is sourced from PubChem (CID 47221365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).