1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone

C9H17N2O2P — CID 90069008

IUPAC1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone
SMILESC=CCN(P)CC(=O)N1CCOCC1
InChIInChI=1S/C9H17N2O2P/c1-2-3-11(14)8-9(12)10-4-6-13-7-5-10/h2H,1,3-8,14H2
InChIKeyIAJASUWWISVAQS-UHFFFAOYSA-N
MW216.22 g/mol
LogP0.12
Rot. Bonds4

About 1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone

1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone (PubChem CID 90069008) has the molecular formula C9H17N2O2P and a molecular weight of 216.22 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone.

Molecular Properties

Compound Name1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone
PubChem CID90069008
Molecular FormulaC9H17N2O2P
Molecular Weight216.22 g/mol
Exact Mass216.10
IUPAC Name1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone
SMILESC=CCN(P)CC(=O)N1CCOCC1
InChIInChI=1S/C9H17N2O2P/c1-2-3-11(14)8-9(12)10-4-6-13-7-5-10/h2H,1,3-8,14H2
InChIKeyIAJASUWWISVAQS-UHFFFAOYSA-N
XLogP0.12
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.22
LogP ≤ 50.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

2-[morpholine-4-carbonyl(prop-2-enyl)amino]acetic acid
CID 79262594
1-morpholin-4-yl-3-(prop-2-enylamino)propan-1-one
CID 109011993
2-[methyl(methylaminomethyl)amino]-1-morpholin-4-ylethanone
CID 177179015
2-[(1-amino-2-methylpropan-2-yl)-methylamino]-1-morpholin-4-ylethanone
CID 62007959
2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetonitrile
CID 60699929
2-[methyl(2-methylsulfanylethyl)amino]-1-morpholin-4-ylethanone
CID 78815658
(2-morpholin-4-yl-2-oxoethyl)azanide;yttrium
CID 176949022
3-[methyl-(3-morpholin-4-yl-3-oxopropyl)amino]-1-morpholin-4-ylpropan-1-one
CID 23422467
2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone
CID 62013792
3-morpholin-4-yl-1-prop-2-enyl-1-sulfanylurea
CID 87837606
2-[cyclopropyl(2-hydroxyethyl)amino]-1-morpholin-4-ylethanone
CID 60774443
morpholin-4-yl-(4-prop-2-enyl-1,4-diazepan-1-yl)methanone
CID 23760989

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone?
The IUPAC name of 1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone (CID 90069008) is 1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone.
What is the SMILES notation for 1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone?
The canonical SMILES for 1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone is C=CCN(P)CC(=O)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone?
The InChIKey is IAJASUWWISVAQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N2O2P/c1-2-3-11(14)8-9(12)10-4-6-13-7-5-10/h2H,1,3-8,14H2.
What are the key properties of 1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone?
1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone has a molecular weight of 216.22 g/mol, XLogP of 0.12, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-2-[phosphanyl(prop-2-enyl)amino]ethanone is sourced from PubChem (CID 90069008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).