N-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide

C16H24N4O2 — CID 56731255

IUPACN-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NC2CCCCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C16H24N4O2/c1-12-11-14(15(21)18-13-5-3-2-4-6-13)19-16(17-12)20-7-9-22-10-8-20/h11,13H,2-10H2,1H3,(H,18,21)
InChIKeyZDTCZZJPZCTGNR-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.68
Rot. Bonds3

About N-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide

N-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide (PubChem CID 56731255) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide
PubChem CID56731255
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC NameN-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NC2CCCCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C16H24N4O2/c1-12-11-14(15(21)18-13-5-3-2-4-6-13)19-16(17-12)20-7-9-22-10-8-20/h11,13H,2-10H2,1H3,(H,18,21)
InChIKeyZDTCZZJPZCTGNR-UHFFFAOYSA-N
XLogP1.68
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide?
The IUPAC name of N-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide (CID 56731255) is N-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide?
The canonical SMILES for N-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide is Cc1cc(C(=O)NC2CCCCC2)nc(N2CCOCC2)n1.
What is the InChIKey of N-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide?
The InChIKey is ZDTCZZJPZCTGNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c1-12-11-14(15(21)18-13-5-3-2-4-6-13)19-16(17-12)20-7-9-22-10-8-20/h11,13H,2-10H2,1H3,(H,18,21).
What are the key properties of N-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide?
N-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide has a molecular weight of 304.39 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide is sourced from PubChem (CID 56731255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).