N-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide

C24H22Cl2N6O — CID 164625441

IUPACN-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESNC1CCN(c2c(NC(=O)c3cn4ccccc4n3)cncc2-c2cc(Cl)cc(Cl)c2)CC1
InChIInChI=1S/C24H22Cl2N6O/c25-16-9-15(10-17(26)11-16)19-12-28-13-20(23(19)31-7-4-18(27)5-8-31)30-24(33)21-14-32-6-2-1-3-22(32)29-21/h1-3,6,9-14,18H,4-5,7-8,27H2,(H,30,33)
InChIKeyKEIGDQLHVNXHKG-UHFFFAOYSA-N
MW481.39 g/mol
LogP4.88
Rot. Bonds4

About N-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide

N-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 164625441) has the molecular formula C24H22Cl2N6O and a molecular weight of 481.39 g/mol. Its IUPAC name is N-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID164625441
Molecular FormulaC24H22Cl2N6O
Molecular Weight481.39 g/mol
Exact Mass480.12
IUPAC NameN-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESNC1CCN(c2c(NC(=O)c3cn4ccccc4n3)cncc2-c2cc(Cl)cc(Cl)c2)CC1
InChIInChI=1S/C24H22Cl2N6O/c25-16-9-15(10-17(26)11-16)19-12-28-13-20(23(19)31-7-4-18(27)5-8-31)30-24(33)21-14-32-6-2-1-3-22(32)29-21/h1-3,6,9-14,18H,4-5,7-8,27H2,(H,30,33)
InChIKeyKEIGDQLHVNXHKG-UHFFFAOYSA-N
XLogP4.88
TPSA88.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500481.39
LogP ≤ 54.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide (CID 164625441) is N-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide is NC1CCN(c2c(NC(=O)c3cn4ccccc4n3)cncc2-c2cc(Cl)cc(Cl)c2)CC1.
What is the InChIKey of N-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is KEIGDQLHVNXHKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22Cl2N6O/c25-16-9-15(10-17(26)11-16)19-12-28-13-20(23(19)31-7-4-18(27)5-8-31)30-24(33)21-14-32-6-2-1-3-22(32)29-21/h1-3,6,9-14,18H,4-5,7-8,27H2,(H,30,33).
What are the key properties of N-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide?
N-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 481.39 g/mol, XLogP of 4.88, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 164625441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).