N-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide

C14H16N6O — CID 90544711

IUPACN-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide
SMILESO=C(Nc1cc(N2CCCCC2)ncn1)c1ncccn1
InChIInChI=1S/C14H16N6O/c21-14(13-15-5-4-6-16-13)19-11-9-12(18-10-17-11)20-7-2-1-3-8-20/h4-6,9-10H,1-3,7-8H2,(H,17,18,19,21)
InChIKeyWYDHLDPDIGCBPS-UHFFFAOYSA-N
MW284.32 g/mol
LogP1.51
Rot. Bonds3

About N-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide

N-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide (PubChem CID 90544711) has the molecular formula C14H16N6O and a molecular weight of 284.32 g/mol. Its IUPAC name is N-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide
PubChem CID90544711
Molecular FormulaC14H16N6O
Molecular Weight284.32 g/mol
Exact Mass284.14
IUPAC NameN-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide
SMILESO=C(Nc1cc(N2CCCCC2)ncn1)c1ncccn1
InChIInChI=1S/C14H16N6O/c21-14(13-15-5-4-6-16-13)19-11-9-12(18-10-17-11)20-7-2-1-3-8-20/h4-6,9-10H,1-3,7-8H2,(H,17,18,19,21)
InChIKeyWYDHLDPDIGCBPS-UHFFFAOYSA-N
XLogP1.51
TPSA83.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]pyrimidine-2-carboxamide
CID 90543989
N-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide
CID 90544433
4-iodo-N-(6-piperidin-1-ylpyrimidin-4-yl)benzamide
CID 90544651
3-chloro-N-(6-piperidin-1-ylpyrimidin-4-yl)benzamide
CID 90544619
1-phenyl-3-(6-piperidin-1-ylpyrimidin-4-yl)urea
CID 90544742
2-methylsulfanyl-N-(6-piperidin-1-ylpyrimidin-4-yl)benzamide
CID 90544631
N-(6-piperidin-1-ylpyrimidin-4-yl)-6-pyrazol-1-ylpyridazine-3-carboxamide
CID 90544740
2-(4-chlorophenyl)-N-(6-piperidin-1-ylpyrimidin-4-yl)acetamide
CID 90544473
N-[2-oxo-2-[(6-piperidin-1-ylpyrimidin-4-yl)amino]ethyl]benzamide
CID 90544511
N-(6-piperidin-1-ylpyrimidin-4-yl)-4-sulfamoylbenzamide
CID 90544462
3-nitro-N-(6-piperidin-1-ylpyrimidin-4-yl)benzamide
CID 90544457
N-[3-[[6-(azepan-1-yl)pyrimidin-4-yl]amino]phenyl]acetamide
CID 112864653

Frequently Asked Questions

What is the IUPAC name of N-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide?
The IUPAC name of N-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide (CID 90544711) is N-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide.
What is the SMILES notation for N-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide?
The canonical SMILES for N-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide is O=C(Nc1cc(N2CCCCC2)ncn1)c1ncccn1.
What is the InChIKey of N-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide?
The InChIKey is WYDHLDPDIGCBPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6O/c21-14(13-15-5-4-6-16-13)19-11-9-12(18-10-17-11)20-7-2-1-3-8-20/h4-6,9-10H,1-3,7-8H2,(H,17,18,19,21).
What are the key properties of N-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide?
N-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide has a molecular weight of 284.32 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide is sourced from PubChem (CID 90544711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).