N-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide

C15H20N6O — CID 133269972

IUPACN-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide
SMILESCCn1cc(NC(=O)C2CCN(c3ncccn3)CC2)cn1
InChIInChI=1S/C15H20N6O/c1-2-21-11-13(10-18-21)19-14(22)12-4-8-20(9-5-12)15-16-6-3-7-17-15/h3,6-7,10-12H,2,4-5,8-9H2,1H3,(H,19,22)
InChIKeyMQLYDDVDPWFUEB-UHFFFAOYSA-N
MW300.37 g/mol
LogP1.55
Rot. Bonds4

About N-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide

N-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide (PubChem CID 133269972) has the molecular formula C15H20N6O and a molecular weight of 300.37 g/mol. Its IUPAC name is N-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide
PubChem CID133269972
Molecular FormulaC15H20N6O
Molecular Weight300.37 g/mol
Exact Mass300.17
IUPAC NameN-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide
SMILESCCn1cc(NC(=O)C2CCN(c3ncccn3)CC2)cn1
InChIInChI=1S/C15H20N6O/c1-2-21-11-13(10-18-21)19-14(22)12-4-8-20(9-5-12)15-16-6-3-7-17-15/h3,6-7,10-12H,2,4-5,8-9H2,1H3,(H,19,22)
InChIKeyMQLYDDVDPWFUEB-UHFFFAOYSA-N
XLogP1.55
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.37
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(5-chloropyrimidin-2-yl)-N-(1-ethylpyrazol-4-yl)piperidine-4-carboxamide
CID 71980297
N-(1-ethylpyrazol-4-yl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide
CID 47813826
N-(1-ethylpyrazol-4-yl)-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-4-carboxamide
CID 133483510
N-(4-ethylphenyl)-1-pyrimidin-2-ylpiperidine-4-carboxamide
CID 3223112
N-(1-ethylpyrazol-4-yl)-1-[[4-(hydroxymethyl)phenyl]methyl]piperidine-4-carboxamide
CID 110009386
N-propyl-1-pyrimidin-2-ylpiperidine-4-carboxamide
CID 3224206
1-(5-chloroquinoline-8-carbonyl)-N-(1-ethylpyrazol-4-yl)piperidine-4-carboxamide
CID 86882198
ethyl N-[4-[(1-pyrimidin-2-ylpiperidine-4-carbonyl)amino]phenyl]carbamate
CID 171678844
1-[(4-cyanophenyl)methyl]-N-(1-ethylpyrazol-4-yl)piperidine-4-carboxamide
CID 86865530
1-[2-(3,5-dimethylanilino)-2-oxoethyl]-N-(1-ethylpyrazol-4-yl)piperidine-4-carboxamide
CID 86865505
N-(4-methoxyphenyl)-1-pyrimidin-2-ylpiperidine-4-carboxamide
CID 3223122
N-(1-ethylpyrazol-4-yl)-1-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]piperidine-4-carboxamide
CID 86881963

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide?
The IUPAC name of N-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide (CID 133269972) is N-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide?
The canonical SMILES for N-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide is CCn1cc(NC(=O)C2CCN(c3ncccn3)CC2)cn1.
What is the InChIKey of N-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide?
The InChIKey is MQLYDDVDPWFUEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6O/c1-2-21-11-13(10-18-21)19-14(22)12-4-8-20(9-5-12)15-16-6-3-7-17-15/h3,6-7,10-12H,2,4-5,8-9H2,1H3,(H,19,22).
What are the key properties of N-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide?
N-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide has a molecular weight of 300.37 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 133269972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).