(1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine

C14H21N — CID 145212515

IUPAC(1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine
SMILESC=C(/C=C\C=C/NC)C/C=C\C=C/CC
InChIInChI=1S/C14H21N/c1-4-5-6-7-8-11-14(2)12-9-10-13-15-3/h5-10,12-13,15H,2,4,11H2,1,3H3/b6-5-,8-7-,12-9-,13-10-
InChIKeyMQAMXVSICZWVSA-GUWLATERSA-N
MW203.33 g/mol
LogP3.74
Rot. Bonds7

About (1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine

(1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine (PubChem CID 145212515) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is (1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine.

Molecular Properties

Compound Name(1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine
PubChem CID145212515
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name(1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine
SMILESC=C(/C=C\C=C/NC)C/C=C\C=C/CC
InChIInChI=1S/C14H21N/c1-4-5-6-7-8-11-14(2)12-9-10-13-15-3/h5-10,12-13,15H,2,4,11H2,1,3H3/b6-5-,8-7-,12-9-,13-10-
InChIKeyMQAMXVSICZWVSA-GUWLATERSA-N
XLogP3.74
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(3Z,5Z)-2-methylideneocta-3,5-dien-1-amine
CID 143910764
1,3-diphenylbenzene;ethane;(1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine;2-phenyl-N-(5-phenylcyclohexa-2,4-dien-1-yl)aniline
CID 145212513
N-methylhepta-2,4-dien-1-amine
CID 54531369
(5E)-octa-3,5-diene
CID 173104147
(1Z,3Z,5Z,7Z)-N-ethyl-3-prop-2-enylidenedeca-1,5,7-trien-1-amine
CID 166724369
(3Z,5E)-octa-3,5-dien-2-one
CID 6428552
ethane;(3Z,5Z)-octa-3,5-diene
CID 142104932
(3Z,5Z)-N-methyl-N-[(3Z)-penta-1,3-dien-2-yl]octa-1,3,5-trien-2-amine
CID 155240504
(3Z)-6-methyl-N-[(1E,3Z)-5-methylhexa-1,3,5-trienyl]hepta-1,3-dien-2-amine
CID 170143241
(1E,3Z)-N-methyl-2-prop-1-en-2-ylhexa-1,3-dien-1-amine
CID 138735527
(3E,5E,9Z)-dodeca-1,3,5,9-tetraen-2-ol
CID 89135352
acetylene;ethane;(2Z,6Z)-5-methylidenenona-2,6-diene
CID 143840325

Frequently Asked Questions

What is the IUPAC name of (1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine?
The IUPAC name of (1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine (CID 145212515) is (1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine.
What is the SMILES notation for (1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine?
The canonical SMILES for (1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine is C=C(/C=C\C=C/NC)C/C=C\C=C/CC.
What is the InChIKey of (1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine?
The InChIKey is MQAMXVSICZWVSA-GUWLATERSA-N. The full InChI is InChI=1S/C14H21N/c1-4-5-6-7-8-11-14(2)12-9-10-13-15-3/h5-10,12-13,15H,2,4,11H2,1,3H3/b6-5-,8-7-,12-9-,13-10-.
What are the key properties of (1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine?
(1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.74, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine is sourced from PubChem (CID 145212515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).