4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine

C23H25N3O2 — CID 1378886

IUPAC4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine
SMILESCCCc1ccc(Oc2cc(N3CCOCC3)nc(-c3ccccc3)n2)cc1
InChIInChI=1S/C23H25N3O2/c1-2-6-18-9-11-20(12-10-18)28-22-17-21(26-13-15-27-16-14-26)24-23(25-22)19-7-4-3-5-8-19/h3-5,7-12,17H,2,6,13-16H2,1H3
InChIKeyDQUNFUCBLTVCRU-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.72
Rot. Bonds6

About 4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine

4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine (PubChem CID 1378886) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is 4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine
PubChem CID1378886
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC Name4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine
SMILESCCCc1ccc(Oc2cc(N3CCOCC3)nc(-c3ccccc3)n2)cc1
InChIInChI=1S/C23H25N3O2/c1-2-6-18-9-11-20(12-10-18)28-22-17-21(26-13-15-27-16-14-26)24-23(25-22)19-7-4-3-5-8-19/h3-5,7-12,17H,2,6,13-16H2,1H3
InChIKeyDQUNFUCBLTVCRU-UHFFFAOYSA-N
XLogP4.72
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

Enecadin
CID 6433114
4-(4-Fluorophenyl)-2-methyl-6-(5-piperidinopentyloxy)pyrimidine hydrochloride
CID 9800750
4-[4-(2-Methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]morpholine
CID 2989573
6-ethyl-5-[4-(3-methoxypropyl)-2-methyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl]pyrimidine-2,4-diamine
CID 23647871
6-ethyl-5-[(2R)-4-(3-methoxypropyl)-2-methyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl]pyrimidine-2,4-diamine
CID 23647872
6-ethyl-5-[(2S)-4-(3-methoxypropyl)-2-methyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl]pyrimidine-2,4-diamine
CID 23647873
2,4-Diphenyl-6-(3-pyrrolidin-1-ylpropoxy)pyrimidine
CID 118723352
4-(Piperidin-1-yl)-2-(4-propoxyphenyl)quinazoline
CID 1590578
4-(4-Butoxybenzylidenehydrazino)-2-methyl-6-morpholinopyrimidine
CID 9589764
4-[2-(2-Methoxyphenyl)quinazolin-4-yl]morpholine
CID 3233117
N,N-diethyl-2-[4-[2-[5-(4-methoxyphenyl)pyrimidin-2-yl]ethynyl]phenoxy]ethanamine
CID 10408758
2-methoxy-N-[2-(4-methoxyphenyl)ethyl]-6-(4-morpholin-4-ylphenyl)pyrimidin-4-amine
CID 11502665

Frequently Asked Questions

What is the IUPAC name of 4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine?
The IUPAC name of 4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine (CID 1378886) is 4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine.
What is the SMILES notation for 4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine?
The canonical SMILES for 4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine is CCCc1ccc(Oc2cc(N3CCOCC3)nc(-c3ccccc3)n2)cc1.
What is the InChIKey of 4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine?
The InChIKey is DQUNFUCBLTVCRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-2-6-18-9-11-20(12-10-18)28-22-17-21(26-13-15-27-16-14-26)24-23(25-22)19-7-4-3-5-8-19/h3-5,7-12,17H,2,6,13-16H2,1H3.
What are the key properties of 4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine?
4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine has a molecular weight of 375.47 g/mol, XLogP of 4.72, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-phenyl-6-(4-propylphenoxy)pyrimidin-4-yl]morpholine is sourced from PubChem (CID 1378886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).