(4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene

C11H20 — CID 59911407

IUPAC(4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene
SMILESC=CC[C@@H](/C(C)=C\C)C(C)C
InChIInChI=1S/C11H20/c1-6-8-11(9(3)4)10(5)7-2/h6-7,9,11H,1,8H2,2-5H3/b10-7-/t11-/m1/s1
InChIKeyGCHZLYIAOHEDBG-ZJRUKIMVSA-N
MW152.28 g/mol
LogP3.80
Rot. Bonds4

About (4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene

(4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene (PubChem CID 59911407) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is (4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene.

Molecular Properties

Compound Name(4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene
PubChem CID59911407
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name(4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene
SMILESC=CC[C@@H](/C(C)=C\C)C(C)C
InChIInChI=1S/C11H20/c1-6-8-11(9(3)4)10(5)7-2/h6-7,9,11H,1,8H2,2-5H3/b10-7-/t11-/m1/s1
InChIKeyGCHZLYIAOHEDBG-ZJRUKIMVSA-N
XLogP3.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene 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

N-[(Z)-4-methyl-3-prop-2-enylhex-4-en-2-yl]methanimine
CID 142059017
(5Z)-5-methylhepta-1,5-dien-4-amine
CID 143795621
4-propan-2-ylhepta-1,6-diene
CID 14140894
(4E,7E)-5,6,7-trimethylnona-1,4,7-triene
CID 20695263
2-(1-hydroxyethyl)pent-4-enoic acid
CID 18940262
(2S,3R)-3-propan-2-ylhex-5-en-2-ol
CID 59911359
2-methyl-3-methylidene-4-prop-2-enylhepta-1,6-diene
CID 162498864
azane;pent-4-en-2-ol
CID 22149561
(2S)-2-[(1S)-1-aminoethyl]pent-4-enoic acid
CID 10866451
(4E,7E)-4,6,7-trimethylnona-1,4,7-triene
CID 20695244
(7E)-4,7,10-trimethyl-5-(3-methylbut-2-enyl)-6-prop-2-enylundeca-1,7,9-triene
CID 140594180
(5Z)-4-propan-2-ylhepta-1,5-diene
CID 59039580

Frequently Asked Questions

What is the IUPAC name of (4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene?
The IUPAC name of (4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene (CID 59911407) is (4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene.
What is the SMILES notation for (4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene?
The canonical SMILES for (4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene is C=CC[C@@H](/C(C)=C\C)C(C)C.
What is the InChIKey of (4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene?
The InChIKey is GCHZLYIAOHEDBG-ZJRUKIMVSA-N. The full InChI is InChI=1S/C11H20/c1-6-8-11(9(3)4)10(5)7-2/h6-7,9,11H,1,8H2,2-5H3/b10-7-/t11-/m1/s1.
What are the key properties of (4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene?
(4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene has a molecular weight of 152.28 g/mol, XLogP of 3.80, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene is sourced from PubChem (CID 59911407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).