N-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide

C19H24ClN5O — CID 69047949

IUPACN-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide
SMILESCN(C)CC(=O)NC1CCN(c2ccc(Cl)c(-c3ccccn3)n2)CC1
InChIInChI=1S/C19H24ClN5O/c1-24(2)13-18(26)22-14-8-11-25(12-9-14)17-7-6-15(20)19(23-17)16-5-3-4-10-21-16/h3-7,10,14H,8-9,11-13H2,1-2H3,(H,22,26)
InChIKeyZXAJIVIHZVIUIP-UHFFFAOYSA-N
MW373.89 g/mol
LogP2.44
Rot. Bonds5

About N-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide

N-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide (PubChem CID 69047949) has the molecular formula C19H24ClN5O and a molecular weight of 373.89 g/mol. Its IUPAC name is N-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide.

Molecular Properties

Compound NameN-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide
PubChem CID69047949
Molecular FormulaC19H24ClN5O
Molecular Weight373.89 g/mol
Exact Mass373.17
IUPAC NameN-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide
SMILESCN(C)CC(=O)NC1CCN(c2ccc(Cl)c(-c3ccccn3)n2)CC1
InChIInChI=1S/C19H24ClN5O/c1-24(2)13-18(26)22-14-8-11-25(12-9-14)17-7-6-15(20)19(23-17)16-5-3-4-10-21-16/h3-7,10,14H,8-9,11-13H2,1-2H3,(H,22,26)
InChIKeyZXAJIVIHZVIUIP-UHFFFAOYSA-N
XLogP2.44
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.89
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide?
The IUPAC name of N-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide (CID 69047949) is N-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide.
What is the SMILES notation for N-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide?
The canonical SMILES for N-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide is CN(C)CC(=O)NC1CCN(c2ccc(Cl)c(-c3ccccn3)n2)CC1.
What is the InChIKey of N-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide?
The InChIKey is ZXAJIVIHZVIUIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24ClN5O/c1-24(2)13-18(26)22-14-8-11-25(12-9-14)17-7-6-15(20)19(23-17)16-5-3-4-10-21-16/h3-7,10,14H,8-9,11-13H2,1-2H3,(H,22,26).
What are the key properties of N-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide?
N-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide has a molecular weight of 373.89 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-chloro-6-pyridin-2-yl-2-pyridinyl)piperidin-4-yl]-2-(dimethylamino)acetamide is sourced from PubChem (CID 69047949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).