N',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide

C9H16N2O — CID 15525104

IUPACN',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide
SMILESC=C(C)C(=O)N(C(=C)C)N(C)C
InChIInChI=1S/C9H16N2O/c1-7(2)9(12)11(8(3)4)10(5)6/h1,3H2,2,4-6H3
InChIKeyVNHJAXWFIODJQG-UHFFFAOYSA-N
MW168.24 g/mol
LogP1.40
Rot. Bonds3

About N',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide

N',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide (PubChem CID 15525104) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is N',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide.

Molecular Properties

Compound NameN',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide
PubChem CID15525104
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC NameN',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide
SMILESC=C(C)C(=O)N(C(=C)C)N(C)C
InChIInChI=1S/C9H16N2O/c1-7(2)9(12)11(8(3)4)10(5)6/h1,3H2,2,4-6H3
InChIKeyVNHJAXWFIODJQG-UHFFFAOYSA-N
XLogP1.40
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

azane;N,N,2-trimethylprop-2-enamide
CID 162327856
N,2-dimethyl-N-(3-methylbuta-1,3-dien-2-yl)prop-2-enamide
CID 171556430
N,N-diacetyl-2-methylprop-2-enamide
CID 22336365
N-(iodomethyl)-N,2-dimethylprop-2-enamide
CID 146497620
N-(1-aminoprop-2-enyl)-N,2-dimethylprop-2-enamide
CID 87537827
N,N-dimethylprop-1-en-2-amine;methane;2-methylprop-1-ene;propan-2-one
CID 158433612
N,N-bis(1,1-dihydroxyethyl)-2-methylprop-2-enamide
CID 153499824
CID 58819112
CID 58819112
N-(2-hydroxypropyl)-2-methylprop-2-enehydrazide
CID 174628871
3,3-bis[methyl(2-methylprop-2-enoyl)amino]propane-1-sulfonic acid
CID 129175414
2-methyl-N-[2-[methyl(2-methylprop-2-enoyl)amino]propyl]prop-2-enamide
CID 174986038
N,2-dimethyl-N-(2,4,4-trimethylpentan-2-yl)prop-2-enamide
CID 87313202

Frequently Asked Questions

What is the IUPAC name of N',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide?
The IUPAC name of N',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide (CID 15525104) is N',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide.
What is the SMILES notation for N',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide?
The canonical SMILES for N',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide is C=C(C)C(=O)N(C(=C)C)N(C)C.
What is the InChIKey of N',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide?
The InChIKey is VNHJAXWFIODJQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c1-7(2)9(12)11(8(3)4)10(5)6/h1,3H2,2,4-6H3.
What are the key properties of N',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide?
N',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide has a molecular weight of 168.24 g/mol, XLogP of 1.40, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide is sourced from PubChem (CID 15525104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).