N-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide

C15H22N4O2 — CID 91771766

IUPACN-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide
SMILESO=C(NC1CCN(C2CCCC2)CC1)c1cnc[nH]c1=O
InChIInChI=1S/C15H22N4O2/c20-14-13(9-16-10-17-14)15(21)18-11-5-7-19(8-6-11)12-3-1-2-4-12/h9-12H,1-8H2,(H,18,21)(H,16,17,20)
InChIKeyRTUKEJLUAFDBOK-UHFFFAOYSA-N
MW290.37 g/mol
LogP0.91
Rot. Bonds3

About N-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide

N-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide (PubChem CID 91771766) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide
PubChem CID91771766
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide
SMILESO=C(NC1CCN(C2CCCC2)CC1)c1cnc[nH]c1=O
InChIInChI=1S/C15H22N4O2/c20-14-13(9-16-10-17-14)15(21)18-11-5-7-19(8-6-11)12-3-1-2-4-12/h9-12H,1-8H2,(H,18,21)(H,16,17,20)
InChIKeyRTUKEJLUAFDBOK-UHFFFAOYSA-N
XLogP0.91
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-((1r,4r)-4-aminocyclohexyl)-4-hydroxypyrimidine-5-carboxamide
CID 132219876
N-(1-(1-(L-alanyl)piperidin-4-yl)ethyl)-4-hydroxypyrimidine-5-carboxamide
CID 132227790
N-((1r,4r)-4-(3-aminopropanamido)cyclohexyl)-4-hydroxypyrimidine-5-carboxamide
CID 132228054
5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one
CID 18935581
N-[1-[1-(2-aminopropanoyl)piperidin-4-yl]ethyl]-6-oxo-1H-pyrimidine-5-carboxamide
CID 146193144
5-({2-[2-(dimethylamino)ethyl]-1-piperidinyl}carbonyl)-2-methyl-4(3H)-pyrimidinone
CID 56914559
5-({4-[1-(dimethylamino)ethyl]-1-piperidinyl}carbonyl)-2-methyl-4(3H)-pyrimidinone
CID 70752567
5-(piperazine-1-carbonyl)-1H-pyrimidin-6-one
CID 82507534
3-Methyl-5-(piperazine-1-carbonyl)pyrimidin-4-one
CID 83890531
6-oxo-N-(1-propylpiperidin-4-yl)-1,6-dihydropyrimidine-5-carboxamide
CID 91769883
N-(5-morpholin-4-ylpentyl)-6-oxo-1,6-dihydropyrimidine-5-carboxamide
CID 91775144
6-oxo-N-[1-(tetrahydro-2H-pyran-4-yl)piperidin-4-yl]-1,6-dihydropyrimidine-5-carboxamide
CID 91796125

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide?
The IUPAC name of N-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide (CID 91771766) is N-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide.
What is the SMILES notation for N-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide?
The canonical SMILES for N-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide is O=C(NC1CCN(C2CCCC2)CC1)c1cnc[nH]c1=O.
What is the InChIKey of N-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide?
The InChIKey is RTUKEJLUAFDBOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c20-14-13(9-16-10-17-14)15(21)18-11-5-7-19(8-6-11)12-3-1-2-4-12/h9-12H,1-8H2,(H,18,21)(H,16,17,20).
What are the key properties of N-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide?
N-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 0.91, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopentylpiperidin-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide is sourced from PubChem (CID 91771766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).