[cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile

C10H20N3O2P — CID 91355106

IUPAC[cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile
SMILESCCNP(C#N)(C#N)(OC(C)C)OC(C)C
InChIInChI=1S/C10H20N3O2P/c1-6-13-16(7-11,8-12,14-9(2)3)15-10(4)5/h9-10,13H,6H2,1-5H3
InChIKeyJNDGYFICMAOKPX-UHFFFAOYSA-N
MW245.26 g/mol
LogP2.71
Rot. Bonds6

About [cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile

[cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile (PubChem CID 91355106) has the molecular formula C10H20N3O2P and a molecular weight of 245.26 g/mol. Its IUPAC name is [cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile.

Molecular Properties

Compound Name[cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile
PubChem CID91355106
Molecular FormulaC10H20N3O2P
Molecular Weight245.26 g/mol
Exact Mass245.13
IUPAC Name[cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile
SMILESCCNP(C#N)(C#N)(OC(C)C)OC(C)C
InChIInChI=1S/C10H20N3O2P/c1-6-13-16(7-11,8-12,14-9(2)3)15-10(4)5/h9-10,13H,6H2,1-5H3
InChIKeyJNDGYFICMAOKPX-UHFFFAOYSA-N
XLogP2.71
TPSA78.07 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.26
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(3R)-3-(ethylamino)butanenitrile
CID 93383163
2-(ethylamino)-4-propan-2-yloxybutanenitrile
CID 63029764
2-(ethylamino)-3-methyl-2-propan-2-ylbutanenitrile
CID 141254263
2-[[(1R)-1-cyclohexylethyl]amino]acetonitrile
CID 81385869
(2S)-5,5-diethoxy-2-propan-2-ylpentanenitrile
CID 95562319
2-(ethylamino)propanenitrile;N-methoxyformamide
CID 23311295
2-methylpropylcyanamide
CID 21399032
2,2,3,4-tetramethylhexanenitrile
CID 130631375
1-ethoxyethylcyanamide
CID 55286094
1-cyclopentyl-N-ethylethanamine
CID 60819244
2-(4-propan-2-yloxybutylamino)butanenitrile
CID 106009913
di(propan-2-yl)alumanylformonitrile
CID 88500264

Frequently Asked Questions

What is the IUPAC name of [cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile?
The IUPAC name of [cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile (CID 91355106) is [cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile.
What is the SMILES notation for [cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile?
The canonical SMILES for [cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile is CCNP(C#N)(C#N)(OC(C)C)OC(C)C.
What is the InChIKey of [cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile?
The InChIKey is JNDGYFICMAOKPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N3O2P/c1-6-13-16(7-11,8-12,14-9(2)3)15-10(4)5/h9-10,13H,6H2,1-5H3.
What are the key properties of [cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile?
[cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile has a molecular weight of 245.26 g/mol, XLogP of 2.71, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [cyano-(ethylamino)-di(propan-2-yloxy)-λ5-phosphanyl]formonitrile is sourced from PubChem (CID 91355106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).