N,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide

C19H24N6O2 — CID 109098942

IUPACN,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide
SMILESCCN(CC)C(=O)c1cccc(C(=O)N2CCN(c3ncccn3)CC2)n1
InChIInChI=1S/C19H24N6O2/c1-3-23(4-2)17(26)15-7-5-8-16(22-15)18(27)24-11-13-25(14-12-24)19-20-9-6-10-21-19/h5-10H,3-4,11-14H2,1-2H3
InChIKeyUNVVZIGVMZLDRM-UHFFFAOYSA-N
MW368.44 g/mol
LogP1.32
Rot. Bonds5

About N,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide

N,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide (PubChem CID 109098942) has the molecular formula C19H24N6O2 and a molecular weight of 368.44 g/mol. Its IUPAC name is N,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide
PubChem CID109098942
Molecular FormulaC19H24N6O2
Molecular Weight368.44 g/mol
Exact Mass368.20
IUPAC NameN,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide
SMILESCCN(CC)C(=O)c1cccc(C(=O)N2CCN(c3ncccn3)CC2)n1
InChIInChI=1S/C19H24N6O2/c1-3-23(4-2)17(26)15-7-5-8-16(22-15)18(27)24-11-13-25(14-12-24)19-20-9-6-10-21-19/h5-10H,3-4,11-14H2,1-2H3
InChIKeyUNVVZIGVMZLDRM-UHFFFAOYSA-N
XLogP1.32
TPSA82.53 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.44
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N,N-diethyl-6-[4-(3-methylphenyl)piperazine-1-carbonyl]pyridine-2-carboxamide
CID 109098913
(4-methylpiperidin-1-yl)-[6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-2-pyridinyl]methanone
CID 109095456
N,N-diethyl-6-(morpholine-4-carbonyl)pyridine-2-carboxamide
CID 109096024
[6-(morpholine-4-carbonyl)-2-pyridinyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 109096023
(1-ethyl-5-methylpyrazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 110681727
[2-(dipropylamino)pyrimidin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 109310660
N,N-diethyl-2-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide
CID 109302072
N-(furan-2-ylmethyl)-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide
CID 109097112
2-ethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridazin-3-one
CID 121066958
(1-methylpyrazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 4770499
pyridazin-3-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 110855018
2-(4-benzylpiperazin-1-yl)-N,N-diethylpyrimidine-4-carboxamide
CID 109309414

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide?
The IUPAC name of N,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide (CID 109098942) is N,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide.
What is the SMILES notation for N,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide?
The canonical SMILES for N,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide is CCN(CC)C(=O)c1cccc(C(=O)N2CCN(c3ncccn3)CC2)n1.
What is the InChIKey of N,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide?
The InChIKey is UNVVZIGVMZLDRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6O2/c1-3-23(4-2)17(26)15-7-5-8-16(22-15)18(27)24-11-13-25(14-12-24)19-20-9-6-10-21-19/h5-10H,3-4,11-14H2,1-2H3.
What are the key properties of N,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide?
N,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide has a molecular weight of 368.44 g/mol, XLogP of 1.32, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide is sourced from PubChem (CID 109098942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).