(Z)-5-methylhept-4-en-2-amine

C8H17N — CID 143746463

IUPAC(Z)-5-methylhept-4-en-2-amine
SMILESCC/C(C)=C\CC(C)N
InChIInChI=1S/C8H17N/c1-4-7(2)5-6-8(3)9/h5,8H,4,6,9H2,1-3H3/b7-5-
InChIKeyBQHUHJBOVVVFQT-ALCCZGGFSA-N
MW127.23 g/mol
LogP2.08
Rot. Bonds3

About (Z)-5-methylhept-4-en-2-amine

(Z)-5-methylhept-4-en-2-amine (PubChem CID 143746463) has the molecular formula C8H17N and a molecular weight of 127.23 g/mol. Its IUPAC name is (Z)-5-methylhept-4-en-2-amine.

Molecular Properties

Compound Name(Z)-5-methylhept-4-en-2-amine
PubChem CID143746463
Molecular FormulaC8H17N
Molecular Weight127.23 g/mol
Exact Mass127.14
IUPAC Name(Z)-5-methylhept-4-en-2-amine
SMILESCC/C(C)=C\CC(C)N
InChIInChI=1S/C8H17N/c1-4-7(2)5-6-8(3)9/h5,8H,4,6,9H2,1-3H3/b7-5-
InChIKeyBQHUHJBOVVVFQT-ALCCZGGFSA-N
XLogP2.08
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.23
LogP ≤ 52.08
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

(E)-3,6,7-trimethyloct-3-ene
CID 167475963
7-bromo-3,6-dimethylhept-3-ene
CID 54367559
3,6,7-trimethyldec-3-ene
CID 123818084
(Z)-3-amino-8-methyldec-7-ene-1,2,4,5-tetrol
CID 173278803
3-methylpent-2-en-1-amine
CID 76997051
ethane;(E)-3-methylpent-2-en-1-amine
CID 143325002
2,2-dimethylpropane;(Z)-3-methylhex-3-ene;2-methylpropane
CID 170712386
(Z,3S)-3,7-dimethylnon-6-en-1-ol
CID 156871638
(E)-5-methyl-2-prop-1-en-2-ylhept-4-en-1-ol
CID 122678118
methane;(E)-3-methylhex-3-ene
CID 157350431
methane;(Z)-3-methylhex-3-ene
CID 168892321
(E)-4-methylhex-3-en-1-amine
CID 63969892

Frequently Asked Questions

What is the IUPAC name of (Z)-5-methylhept-4-en-2-amine?
The IUPAC name of (Z)-5-methylhept-4-en-2-amine (CID 143746463) is (Z)-5-methylhept-4-en-2-amine.
What is the SMILES notation for (Z)-5-methylhept-4-en-2-amine?
The canonical SMILES for (Z)-5-methylhept-4-en-2-amine is CC/C(C)=C\CC(C)N.
What is the InChIKey of (Z)-5-methylhept-4-en-2-amine?
The InChIKey is BQHUHJBOVVVFQT-ALCCZGGFSA-N. The full InChI is InChI=1S/C8H17N/c1-4-7(2)5-6-8(3)9/h5,8H,4,6,9H2,1-3H3/b7-5-.
What are the key properties of (Z)-5-methylhept-4-en-2-amine?
(Z)-5-methylhept-4-en-2-amine has a molecular weight of 127.23 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-methylhept-4-en-2-amine is sourced from PubChem (CID 143746463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).