1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine

C15H20N4O — CID 115315817

IUPAC1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine
SMILESCc1nnc(N2CCOC(C(C)N)C2)c2ccccc12
InChIInChI=1S/C15H20N4O/c1-10(16)14-9-19(7-8-20-14)15-13-6-4-3-5-12(13)11(2)17-18-15/h3-6,10,14H,7-9,16H2,1-2H3
InChIKeyUXJWHXMAXGRCIN-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.49
Rot. Bonds2

About 1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine

1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine (PubChem CID 115315817) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine.

Molecular Properties

Compound Name1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine
PubChem CID115315817
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine
SMILESCc1nnc(N2CCOC(C(C)N)C2)c2ccccc12
InChIInChI=1S/C15H20N4O/c1-10(16)14-9-19(7-8-20-14)15-13-6-4-3-5-12(13)11(2)17-18-15/h3-6,10,14H,7-9,16H2,1-2H3
InChIKeyUXJWHXMAXGRCIN-UHFFFAOYSA-N
XLogP1.49
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-(4-methylphthalazin-1-yl)morpholin-2-yl]methanamine
CID 61337016
1-[4-(6-methylpyridazin-3-yl)morpholin-2-yl]ethanamine
CID 115315932
1-[4-(3-fluoro-2-pyridinyl)morpholin-2-yl]ethanamine
CID 115315766
1-(4-pyrimidin-2-ylmorpholin-2-yl)ethanamine
CID 115315809
1-[4-(2,6-dimethyl-4-pyridinyl)morpholin-2-yl]ethanamine
CID 114272217
1-(4-methylphthalazin-1-yl)piperidin-4-one
CID 43395101
2-[2-(1-aminoethyl)morpholin-4-yl]benzonitrile
CID 113285117
1-[4-(5-methyl-1H-imidazol-2-yl)morpholin-2-yl]ethanamine
CID 106553336
1-[4-(5,6-dimethylpyrazin-2-yl)morpholin-2-yl]ethanamine
CID 114476599
1-(4-methylphthalazin-1-yl)piperidin-4-amine
CID 43517082
N-methyl-1-(4-methylphthalazin-1-yl)pyrrolidin-3-amine
CID 113282080
6-[2-(1-aminoethyl)morpholin-4-yl]-2H-1,2,4-triazine-3,5-dione
CID 115315777

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine?
The IUPAC name of 1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine (CID 115315817) is 1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine.
What is the SMILES notation for 1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine?
The canonical SMILES for 1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine is Cc1nnc(N2CCOC(C(C)N)C2)c2ccccc12.
What is the InChIKey of 1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine?
The InChIKey is UXJWHXMAXGRCIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-10(16)14-9-19(7-8-20-14)15-13-6-4-3-5-12(13)11(2)17-18-15/h3-6,10,14H,7-9,16H2,1-2H3.
What are the key properties of 1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine?
1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine has a molecular weight of 272.35 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-methylphthalazin-1-yl)morpholin-2-yl]ethanamine is sourced from PubChem (CID 115315817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).