2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine

C19H27N5O — CID 95129137

IUPAC2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine
SMILESCc1nc(NC[C@@H](c2cccnc2)N2CCOCC2)cc(C(C)C)n1
InChIInChI=1S/C19H27N5O/c1-14(2)17-11-19(23-15(3)22-17)21-13-18(16-5-4-6-20-12-16)24-7-9-25-10-8-24/h4-6,11-12,14,18H,7-10,13H2,1-3H3,(H,21,22,23)/t18-/m0/s1
InChIKeyJJWFPVGUJFOIQD-SFHVURJKSA-N
MW341.46 g/mol
LogP2.79
Rot. Bonds6

About 2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine

2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine (PubChem CID 95129137) has the molecular formula C19H27N5O and a molecular weight of 341.46 g/mol. Its IUPAC name is 2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine
PubChem CID95129137
Molecular FormulaC19H27N5O
Molecular Weight341.46 g/mol
Exact Mass341.22
IUPAC Name2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine
SMILESCc1nc(NC[C@@H](c2cccnc2)N2CCOCC2)cc(C(C)C)n1
InChIInChI=1S/C19H27N5O/c1-14(2)17-11-19(23-15(3)22-17)21-13-18(16-5-4-6-20-12-16)24-7-9-25-10-8-24/h4-6,11-12,14,18H,7-10,13H2,1-3H3,(H,21,22,23)/t18-/m0/s1
InChIKeyJJWFPVGUJFOIQD-SFHVURJKSA-N
XLogP2.79
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine (CID 95129137) is 2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine is Cc1nc(NC[C@@H](c2cccnc2)N2CCOCC2)cc(C(C)C)n1.
What is the InChIKey of 2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine?
The InChIKey is JJWFPVGUJFOIQD-SFHVURJKSA-N. The full InChI is InChI=1S/C19H27N5O/c1-14(2)17-11-19(23-15(3)22-17)21-13-18(16-5-4-6-20-12-16)24-7-9-25-10-8-24/h4-6,11-12,14,18H,7-10,13H2,1-3H3,(H,21,22,23)/t18-/m0/s1.
What are the key properties of 2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine?
2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine has a molecular weight of 341.46 g/mol, XLogP of 2.79, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-6-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 95129137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).