2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide

C10H20N2O — CID 114617063

IUPAC2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide
SMILESC=C(C)CNC(=O)C(N)(CC)CC
InChIInChI=1S/C10H20N2O/c1-5-10(11,6-2)9(13)12-7-8(3)4/h3,5-7,11H2,1-2,4H3,(H,12,13)
InChIKeyGKBBNJUSBYXABZ-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.20
Rot. Bonds5

About 2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide

2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide (PubChem CID 114617063) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide.

Molecular Properties

Compound Name2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide
PubChem CID114617063
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide
SMILESC=C(C)CNC(=O)C(N)(CC)CC
InChIInChI=1S/C10H20N2O/c1-5-10(11,6-2)9(13)12-7-8(3)4/h3,5-7,11H2,1-2,4H3,(H,12,13)
InChIKeyGKBBNJUSBYXABZ-UHFFFAOYSA-N
XLogP1.20
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.20
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-dimethyl-N-(2-methylprop-2-enyl)butanamide
CID 114618641
5-amino-5-ethyl-2-methylhept-1-en-4-one
CID 116592784
3-chloro-2,2-dimethyl-N-(2-methylprop-2-enyl)propanamide
CID 114615978
2-(ethylamino)-2-methyl-N-(2-methylprop-2-enyl)propanamide
CID 114617159
2-amino-N-(2,2-dimethylbutyl)-2-ethylbutanamide
CID 103461588
2-methylprop-2-enylurea
CID 22226516
3-[(2-amino-2-ethylbutanoyl)amino]-2,2-dimethylpropanoic acid
CID 115427950
2-amino-2-ethyl-N-hexylbutanamide
CID 79810029
2-amino-N-(3-amino-2-hydroxy-3-oxopropyl)-2-ethylbutanamide
CID 106175610
2-amino-2-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)butanamide
CID 106147988
2-amino-2-ethyl-N-[2-(3-methylbutoxy)ethyl]butanamide
CID 79814605
methyl 4-[(2-amino-2-ethylbutanoyl)amino]butanoate
CID 79815089

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide?
The IUPAC name of 2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide (CID 114617063) is 2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide.
What is the SMILES notation for 2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide?
The canonical SMILES for 2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide is C=C(C)CNC(=O)C(N)(CC)CC.
What is the InChIKey of 2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide?
The InChIKey is GKBBNJUSBYXABZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-5-10(11,6-2)9(13)12-7-8(3)4/h3,5-7,11H2,1-2,4H3,(H,12,13).
What are the key properties of 2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide?
2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide has a molecular weight of 184.28 g/mol, XLogP of 1.20, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-ethyl-N-(2-methylprop-2-enyl)butanamide is sourced from PubChem (CID 114617063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).