2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide

C15H19N5O — CID 133358610

IUPAC2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide
SMILESN#Cc1ccc(N2CCN(CC(=O)NC3CC3)CC2)cn1
InChIInChI=1S/C15H19N5O/c16-9-13-3-4-14(10-17-13)20-7-5-19(6-8-20)11-15(21)18-12-1-2-12/h3-4,10,12H,1-2,5-8,11H2,(H,18,21)
InChIKeyRZJJKOPWGKRHNV-UHFFFAOYSA-N
MW285.35 g/mol
LogP0.35
Rot. Bonds4

About 2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide

2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide (PubChem CID 133358610) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide
PubChem CID133358610
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide
SMILESN#Cc1ccc(N2CCN(CC(=O)NC3CC3)CC2)cn1
InChIInChI=1S/C15H19N5O/c16-9-13-3-4-14(10-17-13)20-7-5-19(6-8-20)11-15(21)18-12-1-2-12/h3-4,10,12H,1-2,5-8,11H2,(H,18,21)
InChIKeyRZJJKOPWGKRHNV-UHFFFAOYSA-N
XLogP0.35
TPSA72.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(6-cyano-3-pyridinyl)-N-cyclopropylpiperidine-4-carboxamide
CID 163347938
N-benzyl-2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]acetamide
CID 133369980
N-cyclopropyl-2-[4-(4-fluorophenyl)piperazin-1-yl]acetamide
CID 6465367
5-[4-(2-oxo-2-pyrrolidin-1-ylethyl)-1,4-diazepan-1-yl]pyridine-2-carbonitrile
CID 133335172
N-cyclopropyl-2-(4-phenylpiperazin-1-yl)acetamide
CID 6468807
N-cyclopropyl-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide
CID 22198597
(2R)-1-(6-cyano-3-pyridinyl)-N-cyclopropylpyrrolidine-2-carboxamide
CID 99636693
2-[1-(6-cyano-3-pyridinyl)piperidin-3-yl]acetic acid
CID 113320477
5-(4-methylpiperidin-1-yl)pyridine-2-carbonitrile
CID 79839657
2-[1-(6-cyano-3-pyridinyl)piperidin-4-yl]ethyl acetate
CID 101468380
2-[4-(2-chloro-4-pyridinyl)piperazin-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 133378895
5-[4-(2-aminoethyl)piperidin-1-yl]pyridine-2-carbonitrile
CID 115490407

Frequently Asked Questions

What is the IUPAC name of 2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide?
The IUPAC name of 2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide (CID 133358610) is 2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide?
The canonical SMILES for 2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide is N#Cc1ccc(N2CCN(CC(=O)NC3CC3)CC2)cn1.
What is the InChIKey of 2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide?
The InChIKey is RZJJKOPWGKRHNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c16-9-13-3-4-14(10-17-13)20-7-5-19(6-8-20)11-15(21)18-12-1-2-12/h3-4,10,12H,1-2,5-8,11H2,(H,18,21).
What are the key properties of 2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide?
2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide has a molecular weight of 285.35 g/mol, XLogP of 0.35, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(6-cyano-3-pyridinyl)piperazin-1-yl]-N-cyclopropylacetamide is sourced from PubChem (CID 133358610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).