2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine

C19H24N4O2 — CID 112935476

IUPAC2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine
SMILESc1ccc(-c2cc(NCC3CCCO3)nc(N3CCOCC3)n2)cc1
InChIInChI=1S/C19H24N4O2/c1-2-5-15(6-3-1)17-13-18(20-14-16-7-4-10-25-16)22-19(21-17)23-8-11-24-12-9-23/h1-3,5-6,13,16H,4,7-12,14H2,(H,20,21,22)
InChIKeyPQQSNSWHQIOKPS-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.57
Rot. Bonds5

About 2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine

2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine (PubChem CID 112935476) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine.

Molecular Properties

Compound Name2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine
PubChem CID112935476
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine
SMILESc1ccc(-c2cc(NCC3CCCO3)nc(N3CCOCC3)n2)cc1
InChIInChI=1S/C19H24N4O2/c1-2-5-15(6-3-1)17-13-18(20-14-16-7-4-10-25-16)22-19(21-17)23-8-11-24-12-9-23/h1-3,5-6,13,16H,4,7-12,14H2,(H,20,21,22)
InChIKeyPQQSNSWHQIOKPS-UHFFFAOYSA-N
XLogP2.57
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-benzyl-2-morpholin-4-yl-6-phenylpyrimidin-4-amine
CID 112935485
2-N-(2,6-dimethylphenyl)-4-N-(oxolan-2-ylmethyl)-6-phenylpyrimidine-2,4-diamine
CID 112935652
2-morpholin-4-yl-N-(oxolan-2-ylmethyl)quinazolin-4-amine chloride
CID 53351083
N-[[(2R)-oxolan-2-yl]methyl]-6-phenylpyrimidin-4-amine
CID 1408931
4-N-benzyl-2-N-(oxolan-2-ylmethyl)-6-phenylpyrimidine-2,4-diamine
CID 112935698
4-N-(oxolan-2-ylmethyl)-6-phenyl-2-N-(pyridin-4-ylmethyl)pyrimidine-2,4-diamine
CID 112935622
2-N-[2-(dimethylamino)ethyl]-4-N-(oxolan-2-ylmethyl)-6-phenylpyrimidine-2,4-diamine
CID 112935599
2-morpholin-4-yl-6-phenyl-N-(pyridin-3-ylmethyl)pyrimidin-4-amine
CID 112935500
2-N-(3,4-dimethylphenyl)-4-N-(oxolan-2-ylmethyl)-6-phenylpyrimidine-2,4-diamine
CID 112935650
2-N-(4-methylphenyl)-4-N-(oxolan-2-ylmethyl)-6-phenylpyrimidine-2,4-diamine
CID 112935644
2-N-[3-(dimethylamino)propyl]-4-N-[[(2R)-oxolan-2-yl]methyl]-6-phenylpyrimidine-2,4-diamine
CID 124749031
4-[6-(oxolan-2-ylmethylamino)-2-phenylpyrimidin-4-yl]piperazine-1-carbaldehyde
CID 112880609

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine?
The IUPAC name of 2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine (CID 112935476) is 2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine.
What is the SMILES notation for 2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine?
The canonical SMILES for 2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine is c1ccc(-c2cc(NCC3CCCO3)nc(N3CCOCC3)n2)cc1.
What is the InChIKey of 2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine?
The InChIKey is PQQSNSWHQIOKPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-2-5-15(6-3-1)17-13-18(20-14-16-7-4-10-25-16)22-19(21-17)23-8-11-24-12-9-23/h1-3,5-6,13,16H,4,7-12,14H2,(H,20,21,22).
What are the key properties of 2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine?
2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine has a molecular weight of 340.43 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-N-(oxolan-2-ylmethyl)-6-phenylpyrimidin-4-amine is sourced from PubChem (CID 112935476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).