N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide

C17H21ClN4O2 — CID 47068399

IUPACN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide
SMILESCCC(=O)N1CCCCC1C(=O)NCc1cn2cc(Cl)ccc2n1
InChIInChI=1S/C17H21ClN4O2/c1-2-16(23)22-8-4-3-5-14(22)17(24)19-9-13-11-21-10-12(18)6-7-15(21)20-13/h6-7,10-11,14H,2-5,8-9H2,1H3,(H,19,24)
InChIKeyQDPLNFDEHHODJJ-UHFFFAOYSA-N
MW348.83 g/mol
LogP2.39
Rot. Bonds4

About N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide

N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide (PubChem CID 47068399) has the molecular formula C17H21ClN4O2 and a molecular weight of 348.83 g/mol. Its IUPAC name is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide
PubChem CID47068399
Molecular FormulaC17H21ClN4O2
Molecular Weight348.83 g/mol
Exact Mass348.14
IUPAC NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide
SMILESCCC(=O)N1CCCCC1C(=O)NCc1cn2cc(Cl)ccc2n1
InChIInChI=1S/C17H21ClN4O2/c1-2-16(23)22-8-4-3-5-14(22)17(24)19-9-13-11-21-10-12(18)6-7-15(21)20-13/h6-7,10-11,14H,2-5,8-9H2,1H3,(H,19,24)
InChIKeyQDPLNFDEHHODJJ-UHFFFAOYSA-N
XLogP2.39
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.83
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide?
The IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide (CID 47068399) is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide.
What is the SMILES notation for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide?
The canonical SMILES for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide is CCC(=O)N1CCCCC1C(=O)NCc1cn2cc(Cl)ccc2n1.
What is the InChIKey of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide?
The InChIKey is QDPLNFDEHHODJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21ClN4O2/c1-2-16(23)22-8-4-3-5-14(22)17(24)19-9-13-11-21-10-12(18)6-7-15(21)20-13/h6-7,10-11,14H,2-5,8-9H2,1H3,(H,19,24).
What are the key properties of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide?
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide has a molecular weight of 348.83 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-propanoylpiperidine-2-carboxamide is sourced from PubChem (CID 47068399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).