1-pyrimidin-2-ylpiperidine-4-carboxamide

C10H14N4O — CID 3791901

IUPAC1-pyrimidin-2-ylpiperidine-4-carboxamide
SMILESNC(=O)C1CCN(c2ncccn2)CC1
InChIInChI=1S/C10H14N4O/c11-9(15)8-2-6-14(7-3-8)10-12-4-1-5-13-10/h1,4-5,8H,2-3,6-7H2,(H2,11,15)
InChIKeyCRMQKPLIUDKQPQ-UHFFFAOYSA-N
MW206.25 g/mol
LogP0.18
Rot. Bonds2

About 1-pyrimidin-2-ylpiperidine-4-carboxamide

1-pyrimidin-2-ylpiperidine-4-carboxamide (PubChem CID 3791901) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is 1-pyrimidin-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-pyrimidin-2-ylpiperidine-4-carboxamide
PubChem CID3791901
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name1-pyrimidin-2-ylpiperidine-4-carboxamide
SMILESNC(=O)C1CCN(c2ncccn2)CC1
InChIInChI=1S/C10H14N4O/c11-9(15)8-2-6-14(7-3-8)10-12-4-1-5-13-10/h1,4-5,8H,2-3,6-7H2,(H2,11,15)
InChIKeyCRMQKPLIUDKQPQ-UHFFFAOYSA-N
XLogP0.18
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(Pyrimidin-2-yl)piperidine-4-carboxylic acid
CID 2767267
N-cyclopropyl-1-(pyrimidin-2-yl)piperidine-4-carboxamide
CID 17590602
Bmy 21502
CID 129930
N-[1-(pyrimidin-2-yl)piperidin-4-yl]acetamide
CID 47208637
1-Pyrimidin-2-yl-piperidine-3-carboxylic acid cycloheptylamide
CID 3223374
N-(2-methoxyethyl)-1-(pyrimidin-2-yl)piperidine-3-carboxamide
CID 645990
1-[(Pyrimidin-2-ylsulfanyl)acetyl]piperidine-4-carboxamide
CID 752300
N-(pyrimidin-2-yl)cyclohexanecarboxamide
CID 819233
1-Pyrimidin-2-yl-piperidine-4-carboxylic acid cyclohexylamide
CID 24792244
Cyclohexyl 4-pyrimidin-2-ylpiperazinyl ketone
CID 727067
1-(5-Bromo-2-pyrimidinyl)-4-piperidinecarboxamide
CID 46907712
1-(4-Chloropyrimidin-2-yl)piperidine-4-carboxamide
CID 46907729

Frequently Asked Questions

What is the IUPAC name of 1-pyrimidin-2-ylpiperidine-4-carboxamide?
The IUPAC name of 1-pyrimidin-2-ylpiperidine-4-carboxamide (CID 3791901) is 1-pyrimidin-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-pyrimidin-2-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-pyrimidin-2-ylpiperidine-4-carboxamide is NC(=O)C1CCN(c2ncccn2)CC1.
What is the InChIKey of 1-pyrimidin-2-ylpiperidine-4-carboxamide?
The InChIKey is CRMQKPLIUDKQPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c11-9(15)8-2-6-14(7-3-8)10-12-4-1-5-13-10/h1,4-5,8H,2-3,6-7H2,(H2,11,15).
What are the key properties of 1-pyrimidin-2-ylpiperidine-4-carboxamide?
1-pyrimidin-2-ylpiperidine-4-carboxamide has a molecular weight of 206.25 g/mol, XLogP of 0.18, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrimidin-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 3791901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).