2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one

C18H26N4O3 — CID 70717670

IUPAC2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one
SMILESO=C(c1cnc(C2CC2)[nH]c1=O)N1CCCCC1CN1CCOCC1
InChIInChI=1S/C18H26N4O3/c23-17-15(11-19-16(20-17)13-4-5-13)18(24)22-6-2-1-3-14(22)12-21-7-9-25-10-8-21/h11,13-14H,1-10,12H2,(H,19,20,23)
InChIKeyNOYLYSJKEFYWRS-UHFFFAOYSA-N
MW346.43 g/mol
LogP0.97
Rot. Bonds4

About 2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one

2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one (PubChem CID 70717670) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is 2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one
PubChem CID70717670
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC Name2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one
SMILESO=C(c1cnc(C2CC2)[nH]c1=O)N1CCCCC1CN1CCOCC1
InChIInChI=1S/C18H26N4O3/c23-17-15(11-19-16(20-17)13-4-5-13)18(24)22-6-2-1-3-14(22)12-21-7-9-25-10-8-21/h11,13-14H,1-10,12H2,(H,19,20,23)
InChIKeyNOYLYSJKEFYWRS-UHFFFAOYSA-N
XLogP0.97
TPSA78.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-({4-[(2R*,6S*)-2,6-dimethyl-4-morpholinyl]-1-piperidinyl}carbonyl)-2-methyl-4(3H)-pyrimidinone
CID 56901759
2-Cyclopropyl-5-{[4-(morpholin-4-ylcarbonyl)piperidin-1-yl]carbonyl}pyrimidin-4-ol
CID 70728008
4-hydroxy-2-methyl-N-[1-(morpholin-4-ylcarbonyl)piperidin-4-yl]pyrimidine-5-carboxamide
CID 72909134
2-cyclopropyl-N-ethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1,6-dihydropyrimidine-5-carboxamide
CID 74241645
2-isopropyl-5-{[4-(morpholin-4-ylcarbonyl)piperidin-1-yl]carbonyl}pyrimidin-4(3H)-one
CID 91838492
2-cyclopropyl-5-[(2R)-2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one
CID 96368753
2-cyclopropyl-5-[(2S)-2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one
CID 96368755
2-methyl-5-{[rel-(4S,9aR)-4-propylhexahydropyrazino[2,1-c][1,4]oxazin-8(1H)-yl]carbonyl}-4(3H)-pyrimidinone
CID 155910323

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one?
The IUPAC name of 2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one (CID 70717670) is 2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one.
What is the SMILES notation for 2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one?
The canonical SMILES for 2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one is O=C(c1cnc(C2CC2)[nH]c1=O)N1CCCCC1CN1CCOCC1.
What is the InChIKey of 2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one?
The InChIKey is NOYLYSJKEFYWRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O3/c23-17-15(11-19-16(20-17)13-4-5-13)18(24)22-6-2-1-3-14(22)12-21-7-9-25-10-8-21/h11,13-14H,1-10,12H2,(H,19,20,23).
What are the key properties of 2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one?
2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one has a molecular weight of 346.43 g/mol, XLogP of 0.97, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-1H-pyrimidin-6-one is sourced from PubChem (CID 70717670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).