N-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide

C9H18N2O — CID 154958381

IUPACN-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide
SMILESC=C(C)NCC(=O)N(C)C(C)C
InChIInChI=1S/C9H18N2O/c1-7(2)10-6-9(12)11(5)8(3)4/h8,10H,1,6H2,2-5H3
InChIKeyCYBIIRZMGKAINM-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.98
Rot. Bonds4

About N-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide

N-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide (PubChem CID 154958381) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is N-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide.

Molecular Properties

Compound NameN-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide
PubChem CID154958381
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameN-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide
SMILESC=C(C)NCC(=O)N(C)C(C)C
InChIInChI=1S/C9H18N2O/c1-7(2)10-6-9(12)11(5)8(3)4/h8,10H,1,6H2,2-5H3
InChIKeyCYBIIRZMGKAINM-UHFFFAOYSA-N
XLogP0.98
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide?
The IUPAC name of N-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide (CID 154958381) is N-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide.
What is the SMILES notation for N-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide?
The canonical SMILES for N-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide is C=C(C)NCC(=O)N(C)C(C)C.
What is the InChIKey of N-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide?
The InChIKey is CYBIIRZMGKAINM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-7(2)10-6-9(12)11(5)8(3)4/h8,10H,1,6H2,2-5H3.
What are the key properties of N-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide?
N-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide has a molecular weight of 170.26 g/mol, XLogP of 0.98, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propan-2-yl-2-(prop-1-en-2-ylamino)acetamide is sourced from PubChem (CID 154958381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).