6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine

C15H27N5O — CID 95132117

IUPAC6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine
SMILESCCc1cc(N[C@H](C)CN2CCOCC2)nc(N(C)C)n1
InChIInChI=1S/C15H27N5O/c1-5-13-10-14(18-15(17-13)19(3)4)16-12(2)11-20-6-8-21-9-7-20/h10,12H,5-9,11H2,1-4H3,(H,16,17,18)/t12-/m1/s1
InChIKeyLTRQZHGVORHGKJ-GFCCVEGCSA-N
MW293.41 g/mol
LogP1.24
Rot. Bonds6

About 6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine

6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine (PubChem CID 95132117) has the molecular formula C15H27N5O and a molecular weight of 293.41 g/mol. Its IUPAC name is 6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine
PubChem CID95132117
Molecular FormulaC15H27N5O
Molecular Weight293.41 g/mol
Exact Mass293.22
IUPAC Name6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine
SMILESCCc1cc(N[C@H](C)CN2CCOCC2)nc(N(C)C)n1
InChIInChI=1S/C15H27N5O/c1-5-13-10-14(18-15(17-13)19(3)4)16-12(2)11-20-6-8-21-9-7-20/h10,12H,5-9,11H2,1-4H3,(H,16,17,18)/t12-/m1/s1
InChIKeyLTRQZHGVORHGKJ-GFCCVEGCSA-N
XLogP1.24
TPSA53.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine?
The IUPAC name of 6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine (CID 95132117) is 6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine.
What is the SMILES notation for 6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine?
The canonical SMILES for 6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine is CCc1cc(N[C@H](C)CN2CCOCC2)nc(N(C)C)n1.
What is the InChIKey of 6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine?
The InChIKey is LTRQZHGVORHGKJ-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H27N5O/c1-5-13-10-14(18-15(17-13)19(3)4)16-12(2)11-20-6-8-21-9-7-20/h10,12H,5-9,11H2,1-4H3,(H,16,17,18)/t12-/m1/s1.
What are the key properties of 6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine?
6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine has a molecular weight of 293.41 g/mol, XLogP of 1.24, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine is sourced from PubChem (CID 95132117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).