[2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone

C16H22N2O2 — CID 81483906

IUPAC[2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone
SMILESCC(N)C1CN(C(=O)C2(c3ccccc3)CC2)CCO1
InChIInChI=1S/C16H22N2O2/c1-12(17)14-11-18(9-10-20-14)15(19)16(7-8-16)13-5-3-2-4-6-13/h2-6,12,14H,7-11,17H2,1H3
InChIKeyTYDMJTMQLFRKNG-UHFFFAOYSA-N
MW274.36 g/mol
LogP1.29
Rot. Bonds3

About [2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone

[2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone (PubChem CID 81483906) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is [2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone.

Molecular Properties

Compound Name[2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone
PubChem CID81483906
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name[2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone
SMILESCC(N)C1CN(C(=O)C2(c3ccccc3)CC2)CCO1
InChIInChI=1S/C16H22N2O2/c1-12(17)14-11-18(9-10-20-14)15(19)16(7-8-16)13-5-3-2-4-6-13/h2-6,12,14H,7-11,17H2,1H3
InChIKeyTYDMJTMQLFRKNG-UHFFFAOYSA-N
XLogP1.29
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(difluoromethyl)morpholin-4-yl]-[1-(2-methylphenyl)cyclopropyl]methanone
CID 126772723
[2-(hydroxymethyl)morpholin-4-yl]-(1-phenylcyclopentyl)methanone
CID 81196589
1-[2-(1-aminoethyl)morpholin-4-yl]-4-phenylbutan-1-one
CID 81483913
[2-(1-aminoethyl)morpholin-4-yl]-(2-methylsulfanylphenyl)methanone
CID 81484165
[2-(1-aminoethyl)morpholin-4-yl]-naphthalen-2-ylmethanone
CID 81485463
1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone
CID 81485233
1-[(2S)-2-[(1S)-1-aminoethyl]morpholin-4-yl]-2-(2-fluorophenyl)ethanone
CID 99849466
[2-(4-methylphenyl)morpholin-4-yl]-(4-phenyloxan-4-yl)methanone
CID 121134836
(1-ethylsulfonyl-4-phenylpiperidin-4-yl)-(2-methylmorpholin-4-yl)methanone
CID 78832224
2-amino-1-[2-(1-aminoethyl)morpholin-4-yl]propan-1-one
CID 131134178
[(3S)-3-aminopyrrolidin-1-yl]-(1-phenylcyclopropyl)methanone;hydrochloride
CID 119934201
[2-(1-aminoethyl)morpholin-4-yl]-pyridin-4-ylmethanone
CID 81484704

Frequently Asked Questions

What is the IUPAC name of [2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone?
The IUPAC name of [2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone (CID 81483906) is [2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone.
What is the SMILES notation for [2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone?
The canonical SMILES for [2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone is CC(N)C1CN(C(=O)C2(c3ccccc3)CC2)CCO1.
What is the InChIKey of [2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone?
The InChIKey is TYDMJTMQLFRKNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-12(17)14-11-18(9-10-20-14)15(19)16(7-8-16)13-5-3-2-4-6-13/h2-6,12,14H,7-11,17H2,1H3.
What are the key properties of [2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone?
[2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone has a molecular weight of 274.36 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-aminoethyl)morpholin-4-yl]-(1-phenylcyclopropyl)methanone is sourced from PubChem (CID 81483906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).