(Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine

C9H16N2 — CID 134467495

IUPAC(Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine
SMILESC=C/C(C)=N/C(C)=C\N(C)C
InChIInChI=1S/C9H16N2/c1-6-8(2)10-9(3)7-11(4)5/h6-7H,1H2,2-5H3/b9-7-,10-8+
InChIKeyOLTLVNLOVDNCOR-FKJILZIQSA-N
MW152.24 g/mol
LogP2.06
Rot. Bonds3

About (Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine

(Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine (PubChem CID 134467495) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is (Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine
PubChem CID134467495
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name(Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine
SMILESC=C/C(C)=N/C(C)=C\N(C)C
InChIInChI=1S/C9H16N2/c1-6-8(2)10-9(3)7-11(4)5/h6-7H,1H2,2-5H3/b9-7-,10-8+
InChIKeyOLTLVNLOVDNCOR-FKJILZIQSA-N
XLogP2.06
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine?
The IUPAC name of (Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine (CID 134467495) is (Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine.
What is the SMILES notation for (Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine?
The canonical SMILES for (Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine is C=C/C(C)=N/C(C)=C\N(C)C.
What is the InChIKey of (Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine?
The InChIKey is OLTLVNLOVDNCOR-FKJILZIQSA-N. The full InChI is InChI=1S/C9H16N2/c1-6-8(2)10-9(3)7-11(4)5/h6-7H,1H2,2-5H3/b9-7-,10-8+.
What are the key properties of (Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine?
(Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine has a molecular weight of 152.24 g/mol, XLogP of 2.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-(but-3-en-2-ylideneamino)-N,N-dimethylprop-1-en-1-amine is sourced from PubChem (CID 134467495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).