2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide

C10H20N2O — CID 130350132

IUPAC2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide
SMILESC=C(C(C)C)N(CCC)CC(N)=O
InChIInChI=1S/C10H20N2O/c1-5-6-12(7-10(11)13)9(4)8(2)3/h8H,4-7H2,1-3H3,(H2,11,13)
InChIKeyPFCUKONANLXURU-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.35
Rot. Bonds6

About 2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide

2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide (PubChem CID 130350132) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide.

Molecular Properties

Compound Name2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide
PubChem CID130350132
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide
SMILESC=C(C(C)C)N(CCC)CC(N)=O
InChIInChI=1S/C10H20N2O/c1-5-6-12(7-10(11)13)9(4)8(2)3/h8H,4-7H2,1-3H3,(H2,11,13)
InChIKeyPFCUKONANLXURU-UHFFFAOYSA-N
XLogP1.35
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide?
The IUPAC name of 2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide (CID 130350132) is 2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide.
What is the SMILES notation for 2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide?
The canonical SMILES for 2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide is C=C(C(C)C)N(CCC)CC(N)=O.
What is the InChIKey of 2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide?
The InChIKey is PFCUKONANLXURU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-5-6-12(7-10(11)13)9(4)8(2)3/h8H,4-7H2,1-3H3,(H2,11,13).
What are the key properties of 2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide?
2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide has a molecular weight of 184.28 g/mol, XLogP of 1.35, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-methylbut-1-en-2-yl(propyl)amino]acetamide is sourced from PubChem (CID 130350132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).