(Z)-4-methoxytridec-3-en-5-amine

C14H29NO — CID 143745204

IUPAC(Z)-4-methoxytridec-3-en-5-amine
SMILESCC/C=C(\OC)C(N)CCCCCCCC
InChIInChI=1S/C14H29NO/c1-4-6-7-8-9-10-12-13(15)14(16-3)11-5-2/h11,13H,4-10,12,15H2,1-3H3/b14-11-
InChIKeyIODBZJBNCOEHBR-KAMYIIQDSA-N
MW227.39 g/mol
LogP4.00
Rot. Bonds10

About (Z)-4-methoxytridec-3-en-5-amine

(Z)-4-methoxytridec-3-en-5-amine (PubChem CID 143745204) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is (Z)-4-methoxytridec-3-en-5-amine.

Molecular Properties

Compound Name(Z)-4-methoxytridec-3-en-5-amine
PubChem CID143745204
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name(Z)-4-methoxytridec-3-en-5-amine
SMILESCC/C=C(\OC)C(N)CCCCCCCC
InChIInChI=1S/C14H29NO/c1-4-6-7-8-9-10-12-13(15)14(16-3)11-5-2/h11,13H,4-10,12,15H2,1-3H3/b14-11-
InChIKeyIODBZJBNCOEHBR-KAMYIIQDSA-N
XLogP4.00
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-Methoxy-1,2,3,4,5,8-hexahydronaphthalen-1-amine
CID 53775110
(Z)-6-methoxyoct-6-ene-1,5-diamine
CID 88874149
5-Cyclohexa-1,3-dien-1-yl-2-methoxycyclohexa-2,4-dien-1-amine
CID 123779423
(E)-3-methoxynon-2-en-1-amine
CID 139456741
(E)-6-methoxynon-6-en-1-amine
CID 143414744
1-(3,4-dihydro-2H-pyran-6-yl)pentan-1-amine
CID 102647788
2-(cyclohexen-1-yl)-1-(3,4-dihydro-2H-pyran-6-yl)ethanamine
CID 102648048
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethylhexan-1-amine
CID 102648771
1-(3,4-dihydro-2H-pyran-6-yl)dodecan-1-amine
CID 102648874
1-(3,4-dihydro-2H-pyran-6-yl)octan-1-amine
CID 102648892
1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-amine
CID 102648988
1-(3,4-dihydro-2H-pyran-6-yl)-N-methylhexan-1-amine
CID 102649001

Frequently Asked Questions

What is the IUPAC name of (Z)-4-methoxytridec-3-en-5-amine?
The IUPAC name of (Z)-4-methoxytridec-3-en-5-amine (CID 143745204) is (Z)-4-methoxytridec-3-en-5-amine.
What is the SMILES notation for (Z)-4-methoxytridec-3-en-5-amine?
The canonical SMILES for (Z)-4-methoxytridec-3-en-5-amine is CC/C=C(\OC)C(N)CCCCCCCC.
What is the InChIKey of (Z)-4-methoxytridec-3-en-5-amine?
The InChIKey is IODBZJBNCOEHBR-KAMYIIQDSA-N. The full InChI is InChI=1S/C14H29NO/c1-4-6-7-8-9-10-12-13(15)14(16-3)11-5-2/h11,13H,4-10,12,15H2,1-3H3/b14-11-.
What are the key properties of (Z)-4-methoxytridec-3-en-5-amine?
(Z)-4-methoxytridec-3-en-5-amine has a molecular weight of 227.39 g/mol, XLogP of 4.00, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-methoxytridec-3-en-5-amine is sourced from PubChem (CID 143745204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).