N-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide

C11H22N2 — CID 174183986

IUPACN-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide
SMILES[H]/N=C(\C(C)C)N(C)C/C=C\CCC
InChIInChI=1S/C11H22N2/c1-5-6-7-8-9-13(4)11(12)10(2)3/h7-8,10,12H,5-6,9H2,1-4H3/b8-7-,12-11+
InChIKeyVCBUWXWIAJVRSM-OFALOCIGSA-N
MW182.31 g/mol
LogP2.91
Rot. Bonds5

About N-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide

N-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide (PubChem CID 174183986) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is N-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide.

Molecular Properties

Compound NameN-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide
PubChem CID174183986
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC NameN-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide
SMILES[H]/N=C(\C(C)C)N(C)C/C=C\CCC
InChIInChI=1S/C11H22N2/c1-5-6-7-8-9-13(4)11(12)10(2)3/h7-8,10,12H,5-6,9H2,1-4H3/b8-7-,12-11+
InChIKeyVCBUWXWIAJVRSM-OFALOCIGSA-N
XLogP2.91
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;N-(2-methoxyethyl)-N,2-dimethylpropanimidamide
CID 143160692
(E)-N,N-bis[(E)-hex-2-enyl]hex-2-en-1-amine
CID 87105385
(Z)-4-ethyl-2-methyloct-4-en-3-imine
CID 176962442
(4Z,8E)-dodeca-4,8-diene
CID 12576906
(4E,8E)-dodeca-4,8-diene
CID 12576905
ethane;(E)-oct-4-ene
CID 142055407
N,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide
CID 63177241
(E)-2-methyldec-6-en-3-one
CID 58528187
N-methyl-N-pentadec-2-enylacetamide
CID 123664370
(Z)-1-piperazin-1-ylhex-2-en-1-imine
CID 176921342
(E,2S,3R)-3-methylnon-5-en-2-ol
CID 122413916
3-methylnon-5-en-2-ol
CID 91526423

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide?
The IUPAC name of N-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide (CID 174183986) is N-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide.
What is the SMILES notation for N-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide?
The canonical SMILES for N-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide is [H]/N=C(\C(C)C)N(C)C/C=C\CCC.
What is the InChIKey of N-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide?
The InChIKey is VCBUWXWIAJVRSM-OFALOCIGSA-N. The full InChI is InChI=1S/C11H22N2/c1-5-6-7-8-9-13(4)11(12)10(2)3/h7-8,10,12H,5-6,9H2,1-4H3/b8-7-,12-11+.
What are the key properties of N-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide?
N-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide has a molecular weight of 182.31 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide is sourced from PubChem (CID 174183986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).