(Z)-4-(methoxymethyl)dodec-4-en-1-amine

C14H29NO — CID 103392071

IUPAC(Z)-4-(methoxymethyl)dodec-4-en-1-amine
SMILESCCCCCCC/C=C(/CCCN)COC
InChIInChI=1S/C14H29NO/c1-3-4-5-6-7-8-10-14(13-16-2)11-9-12-15/h10H,3-9,11-13,15H2,1-2H3/b14-10-
InChIKeyRUGQOJPQNXVBTN-UVTDQMKNSA-N
MW227.39 g/mol
LogP3.66
Rot. Bonds11

About (Z)-4-(methoxymethyl)dodec-4-en-1-amine

(Z)-4-(methoxymethyl)dodec-4-en-1-amine (PubChem CID 103392071) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is (Z)-4-(methoxymethyl)dodec-4-en-1-amine.

Molecular Properties

Compound Name(Z)-4-(methoxymethyl)dodec-4-en-1-amine
PubChem CID103392071
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name(Z)-4-(methoxymethyl)dodec-4-en-1-amine
SMILESCCCCCCC/C=C(/CCCN)COC
InChIInChI=1S/C14H29NO/c1-3-4-5-6-7-8-10-14(13-16-2)11-9-12-15/h10H,3-9,11-13,15H2,1-2H3/b14-10-
InChIKeyRUGQOJPQNXVBTN-UVTDQMKNSA-N
XLogP3.66
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

8,8,8-Trifluoro-4-(methoxymethyl)oct-4-en-1-amine
CID 103392090
7,7,7-Trifluoro-4-(methoxymethyl)hept-4-en-1-amine
CID 103392123
4-(Methoxymethyl)cyclohex-3-en-1-amine
CID 68340972
2-(5-Methoxycyclohexen-1-yl)ethanamine
CID 91609641
(4Z,9E)-8-methoxy-4-methylcyclotetradeca-4,9-dien-1-amine
CID 144515512
(Z)-5-methoxy-3-(2-methoxypropyl)hex-3-en-1-amine
CID 155228105
(3Z)-5-methoxy-3-(2-methoxyethylidene)hexan-1-amine
CID 155228157
(Z)-4-(1-methoxyethyl)hex-4-en-2-amine
CID 163745738
4-(Propoxymethyl)cyclohex-3-en-1-amine
CID 83261990
4-(Ethoxymethyl)cyclohex-3-en-1-amine
CID 83262419
4-Cycloheptylidene-5-methoxypentan-1-amine
CID 103392066
4-(Methoxymethyl)hex-4-en-1-amine
CID 103392067

Frequently Asked Questions

What is the IUPAC name of (Z)-4-(methoxymethyl)dodec-4-en-1-amine?
The IUPAC name of (Z)-4-(methoxymethyl)dodec-4-en-1-amine (CID 103392071) is (Z)-4-(methoxymethyl)dodec-4-en-1-amine.
What is the SMILES notation for (Z)-4-(methoxymethyl)dodec-4-en-1-amine?
The canonical SMILES for (Z)-4-(methoxymethyl)dodec-4-en-1-amine is CCCCCCC/C=C(/CCCN)COC.
What is the InChIKey of (Z)-4-(methoxymethyl)dodec-4-en-1-amine?
The InChIKey is RUGQOJPQNXVBTN-UVTDQMKNSA-N. The full InChI is InChI=1S/C14H29NO/c1-3-4-5-6-7-8-10-14(13-16-2)11-9-12-15/h10H,3-9,11-13,15H2,1-2H3/b14-10-.
What are the key properties of (Z)-4-(methoxymethyl)dodec-4-en-1-amine?
(Z)-4-(methoxymethyl)dodec-4-en-1-amine has a molecular weight of 227.39 g/mol, XLogP of 3.66, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-(methoxymethyl)dodec-4-en-1-amine is sourced from PubChem (CID 103392071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).