N-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide

C8H19N2OP — CID 18709506

IUPACN-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide
SMILESCCNC(=O)C(C)C(P)CNC
InChIInChI=1S/C8H19N2OP/c1-4-10-8(11)6(2)7(12)5-9-3/h6-7,9H,4-5,12H2,1-3H3,(H,10,11)
InChIKeyOENXMGVJHISZDC-UHFFFAOYSA-N
MW190.23 g/mol
LogP0.22
Rot. Bonds5

About N-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide

N-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide (PubChem CID 18709506) has the molecular formula C8H19N2OP and a molecular weight of 190.23 g/mol. Its IUPAC name is N-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide.

Molecular Properties

Compound NameN-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide
PubChem CID18709506
Molecular FormulaC8H19N2OP
Molecular Weight190.23 g/mol
Exact Mass190.12
IUPAC NameN-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide
SMILESCCNC(=O)C(C)C(P)CNC
InChIInChI=1S/C8H19N2OP/c1-4-10-8(11)6(2)7(12)5-9-3/h6-7,9H,4-5,12H2,1-3H3,(H,10,11)
InChIKeyOENXMGVJHISZDC-UHFFFAOYSA-N
XLogP0.22
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.23
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-N-ethyl-3-(methylamino)propanamide
CID 89258842
ethane;N-ethyl-2-methylbutanamide
CID 145471862
2-amino-N,N'-diethylpropanediamide
CID 88901749
N-ethyl-4-methyl-2-(methylamino)pentanamide
CID 155260519
2-methyl-N-[2-methyl-3-(methylamino)propyl]butanamide
CID 81478398
2-(2,3-dimethylbutylamino)-N-ethylpropanamide
CID 64571125
2-cyano-N-ethylpropanamide
CID 23199183
3-(methylamino)-2-(methylaminomethyl)-N-[2-methyl-3-[[3-(methylamino)-2-(methylaminomethyl)propanoyl]amino]propyl]propanamide
CID 170390778
3-(2,5-dioxopyrrol-1-yl)-N-ethyl-2-methylbutanamide
CID 155058671
(2R)-N-methyl-2-phosphanylpropan-1-amine
CID 171624131
(2R)-N-ethyl-2-[[4-methyl-5-(methylaminomethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide
CID 126426005
(2R)-2-(tert-butylamino)-N-ethylpropanamide
CID 146263926

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide?
The IUPAC name of N-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide (CID 18709506) is N-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide.
What is the SMILES notation for N-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide?
The canonical SMILES for N-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide is CCNC(=O)C(C)C(P)CNC.
What is the InChIKey of N-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide?
The InChIKey is OENXMGVJHISZDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N2OP/c1-4-10-8(11)6(2)7(12)5-9-3/h6-7,9H,4-5,12H2,1-3H3,(H,10,11).
What are the key properties of N-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide?
N-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide has a molecular weight of 190.23 g/mol, XLogP of 0.22, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-4-(methylamino)-3-phosphanylbutanamide is sourced from PubChem (CID 18709506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).