6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide

C17H24N6O2 — CID 56731236

IUPAC6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NCc2c(C)nn(C)c2C)nc(N2CCOCC2)n1
InChIInChI=1S/C17H24N6O2/c1-11-9-15(20-17(19-11)23-5-7-25-8-6-23)16(24)18-10-14-12(2)21-22(4)13(14)3/h9H,5-8,10H2,1-4H3,(H,18,24)
InChIKeyNRMMDUVBPQQUTL-UHFFFAOYSA-N
MW344.42 g/mol
LogP0.90
Rot. Bonds4

About 6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide

6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide (PubChem CID 56731236) has the molecular formula C17H24N6O2 and a molecular weight of 344.42 g/mol. Its IUPAC name is 6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide.

Molecular Properties

Compound Name6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide
PubChem CID56731236
Molecular FormulaC17H24N6O2
Molecular Weight344.42 g/mol
Exact Mass344.20
IUPAC Name6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NCc2c(C)nn(C)c2C)nc(N2CCOCC2)n1
InChIInChI=1S/C17H24N6O2/c1-11-9-15(20-17(19-11)23-5-7-25-8-6-23)16(24)18-10-14-12(2)21-22(4)13(14)3/h9H,5-8,10H2,1-4H3,(H,18,24)
InChIKeyNRMMDUVBPQQUTL-UHFFFAOYSA-N
XLogP0.90
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-ethyl-5-methylpyrazole-3-carboxamide
CID 28099779
6-methyl-2-piperidin-1-yl-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]pyrimidine-4-carboxamide
CID 46974832
N-isopropyl-2,6-dimethyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]pyrimidine-4-carboxamide
CID 50954229
N-cyclopropyl-5-(2,6-dimethylpyrimidine-4-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide
CID 50974143
N-(1-ethyl-1H-pyrazol-4-yl)-6-methyl-2-(morpholin-4-yl)pyrimidine-4-carboxamide
CID 56731242
(5-methyl-1H-pyrazol-3-yl)-(4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)methanone
CID 56869564
6-methyl-2-(pyrrolidin-1-yl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]pyrimidine-4-carboxamide
CID 60182029
N-(3-ethoxypropyl)-6-methyl-2-piperidin-1-ylpyrimidine-4-carboxamide
CID 71688584
2-(azepan-1-yl)-N-[(1,5-dimethylpyrazol-4-yl)methyl]-6-methylpyrimidine-4-carboxamide
CID 71689406
N-(2-morpholin-4-ylethyl)-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidine-4-carboxamide
CID 71830565
6-methyl-2-morpholin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]pyrimidine-4-carboxamide
CID 91938262
N-(2-methoxyethyl)-6-methyl-2-(1-methylpiperidin-4-yl)pyrimidine-4-carboxamide
CID 95825823

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide?
The IUPAC name of 6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide (CID 56731236) is 6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide.
What is the SMILES notation for 6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide?
The canonical SMILES for 6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide is Cc1cc(C(=O)NCc2c(C)nn(C)c2C)nc(N2CCOCC2)n1.
What is the InChIKey of 6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide?
The InChIKey is NRMMDUVBPQQUTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6O2/c1-11-9-15(20-17(19-11)23-5-7-25-8-6-23)16(24)18-10-14-12(2)21-22(4)13(14)3/h9H,5-8,10H2,1-4H3,(H,18,24).
What are the key properties of 6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide?
6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 0.90, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4-carboxamide is sourced from PubChem (CID 56731236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).