2-(2-methylidenebutylamino)acetamide

C7H14N2O — CID 66047349

IUPAC2-(2-methylidenebutylamino)acetamide
SMILESC=C(CC)CNCC(N)=O
InChIInChI=1S/C7H14N2O/c1-3-6(2)4-9-5-7(8)10/h9H,2-5H2,1H3,(H2,8,10)
InChIKeyAJERIDHOPKODMZ-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.03
Rot. Bonds5

About 2-(2-methylidenebutylamino)acetamide

2-(2-methylidenebutylamino)acetamide (PubChem CID 66047349) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 2-(2-methylidenebutylamino)acetamide.

Molecular Properties

Compound Name2-(2-methylidenebutylamino)acetamide
PubChem CID66047349
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name2-(2-methylidenebutylamino)acetamide
SMILESC=C(CC)CNCC(N)=O
InChIInChI=1S/C7H14N2O/c1-3-6(2)4-9-5-7(8)10/h9H,2-5H2,1H3,(H2,8,10)
InChIKeyAJERIDHOPKODMZ-UHFFFAOYSA-N
XLogP0.03
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(2-methylidenebutylamino)ethoxy]acetamide
CID 106237732
2-(propylamino)acetamide
CID 15839438
2-[(2-amino-2-oxoethyl)amino]acetic acid
CID 87871803
methyl 3-(2-methylidenebutylamino)propanoate
CID 66045929
2-(3-methylbut-3-enylamino)acetamide
CID 114471988
3-oxo-4-(2-oxobutylamino)butanamide
CID 135274363
N-ethylethanamine;propanamide
CID 172821181
N-(2,2-difluoroethyl)-2-methylidenebutan-1-amine
CID 115406522
1-(ethylamino)-4-methylidenehexan-2-one
CID 116562696
N-[2-(2-methylidenebutylamino)ethyl]methanesulfonamide
CID 66047591
N-cyclopropyl-3-(2-methylidenebutylamino)propanamide
CID 79394684
2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide
CID 28586640

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylidenebutylamino)acetamide?
The IUPAC name of 2-(2-methylidenebutylamino)acetamide (CID 66047349) is 2-(2-methylidenebutylamino)acetamide.
What is the SMILES notation for 2-(2-methylidenebutylamino)acetamide?
The canonical SMILES for 2-(2-methylidenebutylamino)acetamide is C=C(CC)CNCC(N)=O.
What is the InChIKey of 2-(2-methylidenebutylamino)acetamide?
The InChIKey is AJERIDHOPKODMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-3-6(2)4-9-5-7(8)10/h9H,2-5H2,1H3,(H2,8,10).
What are the key properties of 2-(2-methylidenebutylamino)acetamide?
2-(2-methylidenebutylamino)acetamide has a molecular weight of 142.20 g/mol, XLogP of 0.03, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylidenebutylamino)acetamide is sourced from PubChem (CID 66047349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).