N,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine

C19H26N4O2 — CID 124998959

IUPACN,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine
SMILESCc1cc(N(C)C)nc([C@@H]2COCCN2CCOc2ccccc2)n1
InChIInChI=1S/C19H26N4O2/c1-15-13-18(22(2)3)21-19(20-15)17-14-24-11-9-23(17)10-12-25-16-7-5-4-6-8-16/h4-8,13,17H,9-12,14H2,1-3H3/t17-/m0/s1
InChIKeyRLLWEIKQXMVLSY-KRWDZBQOSA-N
MW342.44 g/mol
LogP2.30
Rot. Bonds6

About N,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine

N,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine (PubChem CID 124998959) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is N,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine.

Molecular Properties

Compound NameN,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine
PubChem CID124998959
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC NameN,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine
SMILESCc1cc(N(C)C)nc([C@@H]2COCCN2CCOc2ccccc2)n1
InChIInChI=1S/C19H26N4O2/c1-15-13-18(22(2)3)21-19(20-15)17-14-24-11-9-23(17)10-12-25-16-7-5-4-6-8-16/h4-8,13,17H,9-12,14H2,1-3H3/t17-/m0/s1
InChIKeyRLLWEIKQXMVLSY-KRWDZBQOSA-N
XLogP2.30
TPSA50.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine?
The IUPAC name of N,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine (CID 124998959) is N,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine.
What is the SMILES notation for N,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine?
The canonical SMILES for N,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine is Cc1cc(N(C)C)nc([C@@H]2COCCN2CCOc2ccccc2)n1.
What is the InChIKey of N,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine?
The InChIKey is RLLWEIKQXMVLSY-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-15-13-18(22(2)3)21-19(20-15)17-14-24-11-9-23(17)10-12-25-16-7-5-4-6-8-16/h4-8,13,17H,9-12,14H2,1-3H3/t17-/m0/s1.
What are the key properties of N,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine?
N,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine has a molecular weight of 342.44 g/mol, XLogP of 2.30, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine is sourced from PubChem (CID 124998959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).