6-methyl-2-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]pyrimidin-4-amine

C16H24N6O — CID 50982525

IUPAC6-methyl-2-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]pyrimidin-4-amine
SMILESCCCn1cc(CNc2cc(C)nc(N3CCOCC3)n2)cn1
InChIInChI=1S/C16H24N6O/c1-3-4-22-12-14(11-18-22)10-17-15-9-13(2)19-16(20-15)21-5-7-23-8-6-21/h9,11-12H,3-8,10H2,1-2H3,(H,17,19,20)
InChIKeyNLYZXWNEGNWMOG-UHFFFAOYSA-N
MW316.41 g/mol
LogP1.84
Rot. Bonds6

About 6-methyl-2-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]pyrimidin-4-amine

6-methyl-2-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]pyrimidin-4-amine (PubChem CID 50982525) has the molecular formula C16H24N6O and a molecular weight of 316.41 g/mol. Its IUPAC name is 6-methyl-2-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-2-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]pyrimidin-4-amine
PubChem CID50982525
Molecular FormulaC16H24N6O
Molecular Weight316.41 g/mol
Exact Mass316.20
IUPAC Name6-methyl-2-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]pyrimidin-4-amine
SMILESCCCn1cc(CNc2cc(C)nc(N3CCOCC3)n2)cn1
InChIInChI=1S/C16H24N6O/c1-3-4-22-12-14(11-18-22)10-17-15-9-13(2)19-16(20-15)21-5-7-23-8-6-21/h9,11-12H,3-8,10H2,1-2H3,(H,17,19,20)
InChIKeyNLYZXWNEGNWMOG-UHFFFAOYSA-N
XLogP1.84
TPSA68.10 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.41
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

6-methyl-2-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-4-amine
CID 112912257
N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2-morpholin-4-ylpyrimidin-4-amine
CID 112912254
6-methyl-2-morpholin-4-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 112912256
6-methyl-2-morpholin-4-yl-N-[1-(2-propyl-1,2,4-triazol-3-yl)ethyl]pyrimidin-4-amine
CID 50958773
3-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]propan-1-amine
CID 103673638
3-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]propan-1-amine;dihydrochloride
CID 126966477
N-[(1-propylpyrazol-4-yl)methyl]oxan-4-amine
CID 115632215
6-ethyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-4-ylpyrimidin-4-amine
CID 135108999
6-methyl-2-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine
CID 62191776
N-(3,5-dimethylphenyl)-6-methyl-2-morpholin-4-ylpyrimidin-4-amine
CID 112912311
1-propyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-4-amine;hydrochloride
CID 126965152
N-(2-ethylphenyl)-6-methyl-2-morpholin-4-ylpyrimidin-4-amine
CID 112912314

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]pyrimidin-4-amine?
The IUPAC name of 6-methyl-2-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]pyrimidin-4-amine (CID 50982525) is 6-methyl-2-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-methyl-2-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for 6-methyl-2-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]pyrimidin-4-amine is CCCn1cc(CNc2cc(C)nc(N3CCOCC3)n2)cn1.
What is the InChIKey of 6-methyl-2-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]pyrimidin-4-amine?
The InChIKey is NLYZXWNEGNWMOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N6O/c1-3-4-22-12-14(11-18-22)10-17-15-9-13(2)19-16(20-15)21-5-7-23-8-6-21/h9,11-12H,3-8,10H2,1-2H3,(H,17,19,20).
What are the key properties of 6-methyl-2-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]pyrimidin-4-amine?
6-methyl-2-morpholin-4-yl-N-[(1-propylpyrazol-4-yl)methyl]pyrimidin-4-amine has a molecular weight of 316.41 g/mol, XLogP of 1.84, 6 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-propylpyrazol-4-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 50982525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).