2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide

C19H29N5O3 — CID 154819051

IUPAC2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide
SMILESCC(C)NC(=O)N1CCCC2(CCc3c2nc(N2CCOCC2)[nH]c3=O)C1
InChIInChI=1S/C19H29N5O3/c1-13(2)20-18(26)24-7-3-5-19(12-24)6-4-14-15(19)21-17(22-16(14)25)23-8-10-27-11-9-23/h13H,3-12H2,1-2H3,(H,20,26)(H,21,22,25)
InChIKeyMYZAWUQLLCHJJT-UHFFFAOYSA-N
MW375.47 g/mol
LogP1.00
Rot. Bonds2

About 2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide

2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide (PubChem CID 154819051) has the molecular formula C19H29N5O3 and a molecular weight of 375.47 g/mol. Its IUPAC name is 2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide.

Molecular Properties

Compound Name2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide
PubChem CID154819051
Molecular FormulaC19H29N5O3
Molecular Weight375.47 g/mol
Exact Mass375.23
IUPAC Name2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide
SMILESCC(C)NC(=O)N1CCCC2(CCc3c2nc(N2CCOCC2)[nH]c3=O)C1
InChIInChI=1S/C19H29N5O3/c1-13(2)20-18(26)24-7-3-5-19(12-24)6-4-14-15(19)21-17(22-16(14)25)23-8-10-27-11-9-23/h13H,3-12H2,1-2H3,(H,20,26)(H,21,22,25)
InChIKeyMYZAWUQLLCHJJT-UHFFFAOYSA-N
XLogP1.00
TPSA90.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide?
The IUPAC name of 2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide (CID 154819051) is 2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide.
What is the SMILES notation for 2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide?
The canonical SMILES for 2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide is CC(C)NC(=O)N1CCCC2(CCc3c2nc(N2CCOCC2)[nH]c3=O)C1.
What is the InChIKey of 2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide?
The InChIKey is MYZAWUQLLCHJJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N5O3/c1-13(2)20-18(26)24-7-3-5-19(12-24)6-4-14-15(19)21-17(22-16(14)25)23-8-10-27-11-9-23/h13H,3-12H2,1-2H3,(H,20,26)(H,21,22,25).
What are the key properties of 2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide?
2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide has a molecular weight of 375.47 g/mol, XLogP of 1.00, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-4-oxo-N-propan-2-ylspiro[5,6-dihydro-3H-cyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carboxamide is sourced from PubChem (CID 154819051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).