(5Z)-5-methylhepta-1,5-dien-4-amine

C8H15N — CID 143795621

IUPAC(5Z)-5-methylhepta-1,5-dien-4-amine
SMILESC=CCC(N)/C(C)=C\C
InChIInChI=1S/C8H15N/c1-4-6-8(9)7(3)5-2/h4-5,8H,1,6,9H2,2-3H3/b7-5-
InChIKeyBMIIZOOWWLDIFK-ALCCZGGFSA-N
MW125.21 g/mol
LogP1.86
Rot. Bonds3

About (5Z)-5-methylhepta-1,5-dien-4-amine

(5Z)-5-methylhepta-1,5-dien-4-amine (PubChem CID 143795621) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol. Its IUPAC name is (5Z)-5-methylhepta-1,5-dien-4-amine.

Molecular Properties

Compound Name(5Z)-5-methylhepta-1,5-dien-4-amine
PubChem CID143795621
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC Name(5Z)-5-methylhepta-1,5-dien-4-amine
SMILESC=CCC(N)/C(C)=C\C
InChIInChI=1S/C8H15N/c1-4-6-8(9)7(3)5-2/h4-5,8H,1,6,9H2,2-3H3/b7-5-
InChIKeyBMIIZOOWWLDIFK-ALCCZGGFSA-N
XLogP1.86
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.21
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-methylhex-4-en-3-amine
CID 123973735
4-amino-2-methylhepta-1,6-dien-3-one
CID 116606914
(4R,5Z)-5-methyl-4-propan-2-ylhepta-1,5-diene
CID 59911407
(5Z)-8-[(1Z)-buta-1,3-dienoxy]-5-methylocta-1,5-dien-4-amine
CID 89154086
methyl 2-aminopent-4-enoate
CID 10877146
ethane;methyl (2S)-2-aminopent-4-enoate
CID 143525314
(E)-2-prop-2-enoxybut-2-ene
CID 102099599
(2S)-2-aminopent-4-enoic acid;ethane;(3S)-3-methylhex-5-en-2-one
CID 161452637
3-amino-1-methoxyhex-5-en-2-one
CID 116606882
N-[(Z)-4-methyl-3-prop-2-enylhex-4-en-2-yl]methanimine
CID 142059017
2-aminopent-4-enoic acid;cyclohexane
CID 174929503
(2S,3R)-3-aminohex-5-en-2-ol
CID 130715143

Frequently Asked Questions

What is the IUPAC name of (5Z)-5-methylhepta-1,5-dien-4-amine?
The IUPAC name of (5Z)-5-methylhepta-1,5-dien-4-amine (CID 143795621) is (5Z)-5-methylhepta-1,5-dien-4-amine.
What is the SMILES notation for (5Z)-5-methylhepta-1,5-dien-4-amine?
The canonical SMILES for (5Z)-5-methylhepta-1,5-dien-4-amine is C=CCC(N)/C(C)=C\C.
What is the InChIKey of (5Z)-5-methylhepta-1,5-dien-4-amine?
The InChIKey is BMIIZOOWWLDIFK-ALCCZGGFSA-N. The full InChI is InChI=1S/C8H15N/c1-4-6-8(9)7(3)5-2/h4-5,8H,1,6,9H2,2-3H3/b7-5-.
What are the key properties of (5Z)-5-methylhepta-1,5-dien-4-amine?
(5Z)-5-methylhepta-1,5-dien-4-amine has a molecular weight of 125.21 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-methylhepta-1,5-dien-4-amine is sourced from PubChem (CID 143795621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).