(E)-2-methyl-N'-propan-2-ylhex-4-enimidamide

C10H20N2 — CID 138624852

IUPAC(E)-2-methyl-N'-propan-2-ylhex-4-enimidamide
SMILESC/C=C/CC(C)/C(N)=N/C(C)C
InChIInChI=1S/C10H20N2/c1-5-6-7-9(4)10(11)12-8(2)3/h5-6,8-9H,7H2,1-4H3,(H2,11,12)/b6-5+
InChIKeyJEZWISMXVSVHAX-AATRIKPKSA-N
MW168.28 g/mol
LogP2.35
Rot. Bonds4

About (E)-2-methyl-N'-propan-2-ylhex-4-enimidamide

(E)-2-methyl-N'-propan-2-ylhex-4-enimidamide (PubChem CID 138624852) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is (E)-2-methyl-N'-propan-2-ylhex-4-enimidamide.

Molecular Properties

Compound Name(E)-2-methyl-N'-propan-2-ylhex-4-enimidamide
PubChem CID138624852
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name(E)-2-methyl-N'-propan-2-ylhex-4-enimidamide
SMILESC/C=C/CC(C)/C(N)=N/C(C)C
InChIInChI=1S/C10H20N2/c1-5-6-7-9(4)10(11)12-8(2)3/h5-6,8-9H,7H2,1-4H3,(H2,11,12)/b6-5+
InChIKeyJEZWISMXVSVHAX-AATRIKPKSA-N
XLogP2.35
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.35
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 (E)-2-methyl-N'-propan-2-ylhex-4-enimidamide 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

2-methyl-N'-[(3S)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridin-6-yl]propanimidamide
CID 156149008
N'-[(E)-6-amino-6-methylhept-2-enyl]ethanimidamide
CID 21017911
N'-[(Z)-6-amino-6-methylhept-2-enyl]ethanimidamide
CID 58606443
(2R)-2-[(Z)-5-methylhex-2-enyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine
CID 59072761
(2R)-2-[(E)-5-methylhex-2-enyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine
CID 59072786
N'-[(Z)-6-amino-6-methylhept-3-enyl]ethanimidamide
CID 59906751
N'-(6-amino-6-methylhept-2-enyl)ethanimidamide
CID 73733418
N'-(2-methylpent-4-enyl)ethanimidamide
CID 91373134
2-methyl-N'-propan-2-yloct-4-enimidamide
CID 123862547
N'-[(Z)-hex-2-en-3-yl]-2-methylbutanimidamide
CID 132186698
N'-[(E)-hex-4-en-2-yl]-2-methylpropanimidamide
CID 134368296
(E)-3,4-dimethyl-N'-propan-2-ylpent-2-enimidamide
CID 139310002

Frequently Asked Questions

What is the IUPAC name of (E)-2-methyl-N'-propan-2-ylhex-4-enimidamide?
The IUPAC name of (E)-2-methyl-N'-propan-2-ylhex-4-enimidamide (CID 138624852) is (E)-2-methyl-N'-propan-2-ylhex-4-enimidamide.
What is the SMILES notation for (E)-2-methyl-N'-propan-2-ylhex-4-enimidamide?
The canonical SMILES for (E)-2-methyl-N'-propan-2-ylhex-4-enimidamide is C/C=C/CC(C)/C(N)=N/C(C)C.
What is the InChIKey of (E)-2-methyl-N'-propan-2-ylhex-4-enimidamide?
The InChIKey is JEZWISMXVSVHAX-AATRIKPKSA-N. The full InChI is InChI=1S/C10H20N2/c1-5-6-7-9(4)10(11)12-8(2)3/h5-6,8-9H,7H2,1-4H3,(H2,11,12)/b6-5+.
What are the key properties of (E)-2-methyl-N'-propan-2-ylhex-4-enimidamide?
(E)-2-methyl-N'-propan-2-ylhex-4-enimidamide has a molecular weight of 168.28 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-methyl-N'-propan-2-ylhex-4-enimidamide is sourced from PubChem (CID 138624852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).