N-cyclopropyl-3-(2-methylidenebutylamino)propanamide

C11H20N2O — CID 79394684

IUPACN-cyclopropyl-3-(2-methylidenebutylamino)propanamide
SMILESC=C(CC)CNCCC(=O)NC1CC1
InChIInChI=1S/C11H20N2O/c1-3-9(2)8-12-7-6-11(14)13-10-4-5-10/h10,12H,2-8H2,1H3,(H,13,14)
InChIKeyUQUVMSWDQAUMIU-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.21
Rot. Bonds7

About N-cyclopropyl-3-(2-methylidenebutylamino)propanamide

N-cyclopropyl-3-(2-methylidenebutylamino)propanamide (PubChem CID 79394684) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N-cyclopropyl-3-(2-methylidenebutylamino)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(2-methylidenebutylamino)propanamide
PubChem CID79394684
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN-cyclopropyl-3-(2-methylidenebutylamino)propanamide
SMILESC=C(CC)CNCCC(=O)NC1CC1
InChIInChI=1S/C11H20N2O/c1-3-9(2)8-12-7-6-11(14)13-10-4-5-10/h10,12H,2-8H2,1H3,(H,13,14)
InChIKeyUQUVMSWDQAUMIU-UHFFFAOYSA-N
XLogP1.21
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopropyl-3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide
CID 62626302
3-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N-ethylpropanamide
CID 62325687
N-cyclopropyl-3-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide
CID 79394765
3-[[2-(cyclopropylamino)-2-oxoethyl]amino]propanoic acid
CID 43466674
N-cyclopropyl-3-(2-methylsulfanylethylamino)propanamide
CID 62352584
N-cyclopropyl-3-[[2-oxo-2-(pentan-2-ylamino)ethyl]amino]propanamide
CID 79394119
N-cyclopropyl-3-[[2-(ethylamino)acetyl]amino]propanamide
CID 79400683
N-cyclopropyl-3-(octylamino)propanamide
CID 79393740
N-cyclopropyl-3-[[2-(2-methylpropylamino)-2-oxoethyl]amino]propanamide
CID 79394275
3-(cyanomethylamino)-N-cyclopropylpropanamide
CID 79394850
N-(4-methylcyclohexyl)-2-(propylamino)acetamide
CID 60671942
N-cyclopropyl-3-(2-methylpropylamino)propanamide
CID 62626467

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(2-methylidenebutylamino)propanamide?
The IUPAC name of N-cyclopropyl-3-(2-methylidenebutylamino)propanamide (CID 79394684) is N-cyclopropyl-3-(2-methylidenebutylamino)propanamide.
What is the SMILES notation for N-cyclopropyl-3-(2-methylidenebutylamino)propanamide?
The canonical SMILES for N-cyclopropyl-3-(2-methylidenebutylamino)propanamide is C=C(CC)CNCCC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-(2-methylidenebutylamino)propanamide?
The InChIKey is UQUVMSWDQAUMIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-3-9(2)8-12-7-6-11(14)13-10-4-5-10/h10,12H,2-8H2,1H3,(H,13,14).
What are the key properties of N-cyclopropyl-3-(2-methylidenebutylamino)propanamide?
N-cyclopropyl-3-(2-methylidenebutylamino)propanamide has a molecular weight of 196.29 g/mol, XLogP of 1.21, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(2-methylidenebutylamino)propanamide is sourced from PubChem (CID 79394684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).