N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide

C16H22N6O2 — CID 122353805

IUPACN-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide
SMILESCc1cc(CNC(=O)C(C)n2cccn2)nc(N2CCOCC2)n1
InChIInChI=1S/C16H22N6O2/c1-12-10-14(20-16(19-12)21-6-8-24-9-7-21)11-17-15(23)13(2)22-5-3-4-18-22/h3-5,10,13H,6-9,11H2,1-2H3,(H,17,23)
InChIKeySZMIARANHGQKRV-UHFFFAOYSA-N
MW330.39 g/mol
LogP0.70
Rot. Bonds5

About N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide

N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide (PubChem CID 122353805) has the molecular formula C16H22N6O2 and a molecular weight of 330.39 g/mol. Its IUPAC name is N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide
PubChem CID122353805
Molecular FormulaC16H22N6O2
Molecular Weight330.39 g/mol
Exact Mass330.18
IUPAC NameN-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide
SMILESCc1cc(CNC(=O)C(C)n2cccn2)nc(N2CCOCC2)n1
InChIInChI=1S/C16H22N6O2/c1-12-10-14(20-16(19-12)21-6-8-24-9-7-21)11-17-15(23)13(2)22-5-3-4-18-22/h3-5,10,13H,6-9,11H2,1-2H3,(H,17,23)
InChIKeySZMIARANHGQKRV-UHFFFAOYSA-N
XLogP0.70
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

(2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide
CID 94037913
N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrimidin-2-yloxyacetamide
CID 72718392
1-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-3-phenylurea
CID 91967530
5-methyl-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-1,2-oxazole-4-carboxamide
CID 122353746
2-chloro-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]benzamide
CID 72718377
N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-3-phenylpropanamide
CID 91967478
1-methyl-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]triazole-4-carboxamide
CID 122353728
N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-(3-methylphenyl)acetamide
CID 122353695
2-indol-1-yl-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide
CID 122353777
2,4-dimethyl-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]benzamide
CID 91967457
1-(4-tert-butylphenyl)-3-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]urea
CID 122353897
1-(3,5-dimethoxyphenyl)-3-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]urea
CID 91967504

Frequently Asked Questions

What is the IUPAC name of N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide?
The IUPAC name of N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide (CID 122353805) is N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide?
The canonical SMILES for N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide is Cc1cc(CNC(=O)C(C)n2cccn2)nc(N2CCOCC2)n1.
What is the InChIKey of N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide?
The InChIKey is SZMIARANHGQKRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N6O2/c1-12-10-14(20-16(19-12)21-6-8-24-9-7-21)11-17-15(23)13(2)22-5-3-4-18-22/h3-5,10,13H,6-9,11H2,1-2H3,(H,17,23).
What are the key properties of N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide?
N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide has a molecular weight of 330.39 g/mol, XLogP of 0.70, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrazol-1-ylpropanamide is sourced from PubChem (CID 122353805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).