[4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine

C15H24N2O — CID 116941120

IUPAC[4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine
SMILESCC(C)Cc1ccc(C(N)C2COCCN2)cc1
InChIInChI=1S/C15H24N2O/c1-11(2)9-12-3-5-13(6-4-12)15(16)14-10-18-8-7-17-14/h3-6,11,14-15,17H,7-10,16H2,1-2H3
InChIKeyDXKZUTIGWYPCSC-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.87
Rot. Bonds4

About [4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine

[4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine (PubChem CID 116941120) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is [4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine.

Molecular Properties

Compound Name[4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine
PubChem CID116941120
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name[4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine
SMILESCC(C)Cc1ccc(C(N)C2COCCN2)cc1
InChIInChI=1S/C15H24N2O/c1-11(2)9-12-3-5-13(6-4-12)15(16)14-10-18-8-7-17-14/h3-6,11,14-15,17H,7-10,16H2,1-2H3
InChIKeyDXKZUTIGWYPCSC-UHFFFAOYSA-N
XLogP1.87
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(2-methylpropyl)phenyl]-2-morpholin-3-ylethanamine
CID 116941475
(4-chlorophenyl)-morpholin-3-ylmethanamine
CID 116941105
cyclopropyl-[4-(2-methylpropyl)phenyl]methanamine
CID 4579734
morpholin-3-yl(naphthalen-2-yl)methanamine
CID 116941220
[4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanone
CID 116919590
N-[4-(2-methylpropyl)phenyl]morpholine-3-carboxamide
CID 115177537
5-[amino(morpholin-3-yl)methyl]-1,3-dihydrobenzimidazol-2-one
CID 116941178
1-[4-(2-methylpropyl)phenyl]-2-(oxolan-3-yloxy)ethanamine
CID 63558840
6-[amino(morpholin-3-yl)methyl]-3-methyl-1,3-benzoxazol-2-one
CID 116941185
4-[amino-[4-(2-methylpropyl)phenyl]methyl]cyclohexan-1-amine
CID 116937134
1-(4-ethylphenyl)-2-morpholin-3-ylethanamine
CID 116941455
morpholin-3-yl-(2,3,5,6-tetramethylphenyl)methanamine
CID 116941137

Frequently Asked Questions

What is the IUPAC name of [4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine?
The IUPAC name of [4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine (CID 116941120) is [4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine.
What is the SMILES notation for [4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine?
The canonical SMILES for [4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine is CC(C)Cc1ccc(C(N)C2COCCN2)cc1.
What is the InChIKey of [4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine?
The InChIKey is DXKZUTIGWYPCSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-11(2)9-12-3-5-13(6-4-12)15(16)14-10-18-8-7-17-14/h3-6,11,14-15,17H,7-10,16H2,1-2H3.
What are the key properties of [4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine?
[4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine has a molecular weight of 248.37 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-methylpropyl)phenyl]-morpholin-3-ylmethanamine is sourced from PubChem (CID 116941120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).