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

C14H20N6O — CID 141200703

IUPACN-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine
SMILESCNc1cc(-c2cnn(CCN3CCOCC3)c2)ncn1
InChIInChI=1S/C14H20N6O/c1-15-14-8-13(16-11-17-14)12-9-18-20(10-12)3-2-19-4-6-21-7-5-19/h8-11H,2-7H2,1H3,(H,15,16,17)
InChIKeyZFDAAKRAXYRVTP-UHFFFAOYSA-N
MW288.36 g/mol
LogP0.71
Rot. Bonds5

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

N-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine (PubChem CID 141200703) has the molecular formula C14H20N6O and a molecular weight of 288.36 g/mol. Its IUPAC name is N-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine
PubChem CID141200703
Molecular FormulaC14H20N6O
Molecular Weight288.36 g/mol
Exact Mass288.17
IUPAC NameN-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine
SMILESCNc1cc(-c2cnn(CCN3CCOCC3)c2)ncn1
InChIInChI=1S/C14H20N6O/c1-15-14-8-13(16-11-17-14)12-9-18-20(10-12)3-2-19-4-6-21-7-5-19/h8-11H,2-7H2,1H3,(H,15,16,17)
InChIKeyZFDAAKRAXYRVTP-UHFFFAOYSA-N
XLogP0.71
TPSA68.10 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.36
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-[6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-yl]oxyaniline
CID 58917079
6-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine
CID 117094011
6-(3-methylphenyl)-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine
CID 117080618
[7-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1,5-naphthyridin-2-yl]urea
CID 90288240
4-[2-[4-(4-methyl-3-morpholin-4-ylsulfonylphenyl)pyrazol-1-yl]ethyl]morpholine
CID 171431398
5-iodo-6-(2-methylpropyl)-N-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine
CID 154872647
3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine
CID 162672428
N-[4-(morpholin-4-ylmethyl)phenyl]-6-phenylpyrimidin-4-amine
CID 108773217
5-(methylamino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 107374273
6-[2-(methylamino)imidazol-1-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine
CID 163740126
6-N-methyl-4-N-(2-piperidin-1-ylethyl)pyrimidine-4,6-diamine
CID 80805097
N-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine
CID 106715810

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine?
The IUPAC name of N-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine (CID 141200703) is N-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine.
What is the SMILES notation for N-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine?
The canonical SMILES for N-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine is CNc1cc(-c2cnn(CCN3CCOCC3)c2)ncn1.
What is the InChIKey of N-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine?
The InChIKey is ZFDAAKRAXYRVTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6O/c1-15-14-8-13(16-11-17-14)12-9-18-20(10-12)3-2-19-4-6-21-7-5-19/h8-11H,2-7H2,1H3,(H,15,16,17).
What are the key properties of N-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine?
N-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine has a molecular weight of 288.36 g/mol, XLogP of 0.71, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine is sourced from PubChem (CID 141200703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).