1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea

C15H24N4O2 — CID 61339652

IUPAC1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea
SMILESCC(N)c1cccc(NC(=O)NCCN2CCOCC2)c1
InChIInChI=1S/C15H24N4O2/c1-12(16)13-3-2-4-14(11-13)18-15(20)17-5-6-19-7-9-21-10-8-19/h2-4,11-12H,5-10,16H2,1H3,(H2,17,18,20)
InChIKeyFMYGQVCZSHSFCB-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.16
Rot. Bonds5

About 1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea

1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea (PubChem CID 61339652) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea.

Molecular Properties

Compound Name1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea
PubChem CID61339652
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea
SMILESCC(N)c1cccc(NC(=O)NCCN2CCOCC2)c1
InChIInChI=1S/C15H24N4O2/c1-12(16)13-3-2-4-14(11-13)18-15(20)17-5-6-19-7-9-21-10-8-19/h2-4,11-12H,5-10,16H2,1H3,(H2,17,18,20)
InChIKeyFMYGQVCZSHSFCB-UHFFFAOYSA-N
XLogP1.16
TPSA79.62 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-(1-aminoethyl)phenyl]-3-propylurea
CID 43210542
1-(3-chloro-4-methylphenyl)-3-(2-morpholin-4-ylethyl)urea
CID 3579443
1-[3-(1-aminoethyl)phenyl]-3-(2-methoxyethyl)urea
CID 61340896
1-[3-(1-aminoethyl)phenyl]-3-[(4-methylmorpholin-2-yl)methyl]urea
CID 79071437
1-[3-(1-aminoethyl)phenyl]-3-(2-methylsulfonylethyl)urea
CID 61340525
methyl 3-[[3-(1-aminoethyl)phenyl]carbamoylamino]propanoate
CID 61341694
3-(2-methylpropanoylamino)-N-(2-morpholin-4-ylethyl)benzamide
CID 4051447
2-amino-N-(2-morpholin-4-ylethyl)-2-phenylacetamide;dihydrochloride
CID 119827759
1-(3,5-dichloro-4-hydroxyphenyl)-3-(2-morpholin-4-ylethyl)urea
CID 22932427
1-[3-(1-aminoethyl)phenyl]-3-(3-cyclopentylpropyl)urea
CID 106014699
1-(2-morpholin-4-ylethyl)-3-[2-[(1R)-1-phenylethyl]pyrazol-3-yl]urea
CID 97283704
1-(2-morpholin-4-ylethyl)-3-[2-(1-phenylethyl)pyrazol-3-yl]urea
CID 72924199

Frequently Asked Questions

What is the IUPAC name of 1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea?
The IUPAC name of 1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea (CID 61339652) is 1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea.
What is the SMILES notation for 1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea?
The canonical SMILES for 1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea is CC(N)c1cccc(NC(=O)NCCN2CCOCC2)c1.
What is the InChIKey of 1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea?
The InChIKey is FMYGQVCZSHSFCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-12(16)13-3-2-4-14(11-13)18-15(20)17-5-6-19-7-9-21-10-8-19/h2-4,11-12H,5-10,16H2,1H3,(H2,17,18,20).
What are the key properties of 1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea?
1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea has a molecular weight of 292.38 g/mol, XLogP of 1.16, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea is sourced from PubChem (CID 61339652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).