[4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine

C14H19ClN2O2 — CID 114398605

IUPAC[4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine
SMILESNCC1CN(CC2Cc3cc(Cl)ccc3O2)CCO1
InChIInChI=1S/C14H19ClN2O2/c15-11-1-2-14-10(5-11)6-12(19-14)8-17-3-4-18-13(7-16)9-17/h1-2,5,12-13H,3-4,6-9,16H2
InChIKeyFFUUTCPZQHMFSG-UHFFFAOYSA-N
MW282.77 g/mol
LogP1.30
Rot. Bonds3

About [4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine

[4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine (PubChem CID 114398605) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is [4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine.

Molecular Properties

Compound Name[4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine
PubChem CID114398605
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC Name[4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine
SMILESNCC1CN(CC2Cc3cc(Cl)ccc3O2)CCO1
InChIInChI=1S/C14H19ClN2O2/c15-11-1-2-14-10(5-11)6-12(19-14)8-17-3-4-18-13(7-16)9-17/h1-2,5,12-13H,3-4,6-9,16H2
InChIKeyFFUUTCPZQHMFSG-UHFFFAOYSA-N
XLogP1.30
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine with MolForge

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Related Compounds

[(2S)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]methanamine
CID 40566108
1-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]piperidin-4-ol
CID 66361048
1-[1-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]piperidin-4-yl]ethanamine
CID 66360453
[4-[(2,4-dichlorophenyl)methyl]morpholin-2-yl]methanamine
CID 114393379
[4-[(4-chloro-2-fluorophenyl)methyl]morpholin-2-yl]methanamine;hydrochloride
CID 120844387
3-amino-1-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]pyrrolidine-3-carboxylic acid
CID 107324560
[(2S)-4-[(5-chloro-2-ethoxyphenyl)methyl]morpholin-2-yl]methanamine;hydrochloride
CID 171625171
N-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-morpholin-4-ylethanamine
CID 66394124
4-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholine-2-carboximidamide
CID 79676154
1-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2,2-dimethylpiperazine
CID 66361033
[4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]methanamine
CID 10308229
[(2R)-4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]methanamine
CID 11346392

Frequently Asked Questions

What is the IUPAC name of [4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine?
The IUPAC name of [4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine (CID 114398605) is [4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine.
What is the SMILES notation for [4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine?
The canonical SMILES for [4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine is NCC1CN(CC2Cc3cc(Cl)ccc3O2)CCO1.
What is the InChIKey of [4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine?
The InChIKey is FFUUTCPZQHMFSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c15-11-1-2-14-10(5-11)6-12(19-14)8-17-3-4-18-13(7-16)9-17/h1-2,5,12-13H,3-4,6-9,16H2.
What are the key properties of [4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine?
[4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine has a molecular weight of 282.77 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]morpholin-2-yl]methanamine is sourced from PubChem (CID 114398605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).