(Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine

C9H17NO — CID 134201606

IUPAC(Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine
SMILESC/C=C(\O/C=C(/C)N)C(C)C
InChIInChI=1S/C9H17NO/c1-5-9(7(2)3)11-6-8(4)10/h5-7H,10H2,1-4H3/b8-6-,9-5-
InChIKeyCFXGCAABWBQIAV-VZPCVYTNSA-N
MW155.24 g/mol
LogP2.38
Rot. Bonds3

About (Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine

(Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine (PubChem CID 134201606) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is (Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine.

Molecular Properties

Compound Name(Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine
PubChem CID134201606
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name(Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine
SMILESC/C=C(\O/C=C(/C)N)C(C)C
InChIInChI=1S/C9H17NO/c1-5-9(7(2)3)11-6-8(4)10/h5-7H,10H2,1-4H3/b8-6-,9-5-
InChIKeyCFXGCAABWBQIAV-VZPCVYTNSA-N
XLogP2.38
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine?
The IUPAC name of (Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine (CID 134201606) is (Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine.
What is the SMILES notation for (Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine?
The canonical SMILES for (Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine is C/C=C(\O/C=C(/C)N)C(C)C.
What is the InChIKey of (Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine?
The InChIKey is CFXGCAABWBQIAV-VZPCVYTNSA-N. The full InChI is InChI=1S/C9H17NO/c1-5-9(7(2)3)11-6-8(4)10/h5-7H,10H2,1-4H3/b8-6-,9-5-.
What are the key properties of (Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine?
(Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine has a molecular weight of 155.24 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-[(Z)-4-methylpent-2-en-3-yl]oxyprop-1-en-2-amine is sourced from PubChem (CID 134201606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).