1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine

C14H24N2 — CID 123286955

IUPAC1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine
SMILESC=CC(=C)CCCC(/C=C/C)=NC(N)CC
InChIInChI=1S/C14H24N2/c1-5-9-13(16-14(15)7-3)11-8-10-12(4)6-2/h5-6,9,14H,2,4,7-8,10-11,15H2,1,3H3/b9-5+,16-13?
InChIKeyUUZHANNKDUJUNE-WTKXWPBNSA-N
MW220.36 g/mol
LogP3.61
Rot. Bonds8

About 1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine

1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine (PubChem CID 123286955) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine.

Molecular Properties

Compound Name1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine
PubChem CID123286955
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine
SMILESC=CC(=C)CCCC(/C=C/C)=NC(N)CC
InChIInChI=1S/C14H24N2/c1-5-9-13(16-14(15)7-3)11-8-10-12(4)6-2/h5-6,9,14H,2,4,7-8,10-11,15H2,1,3H3/b9-5+,16-13?
InChIKeyUUZHANNKDUJUNE-WTKXWPBNSA-N
XLogP3.61
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

5-(2,5-Dimethylbenzimidazol-2-yl)pentan-1-amine
CID 54088930
1-[(6-Methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethanamine
CID 68342709
[6-(3-Methylideneoctyl)-2,3-dihydropyridin-2-yl]methanamine
CID 91229717
6-(Cyclohexen-1-yl)-2,3,4,5-tetrahydropyridin-2-amine
CID 122664606
1-[(3Z)-3-(1-propylbut-1-enyl)hepta-3,5-dien-2-ylidene]guanidine
CID 123240595
1-(2,3-Dihydropyridin-6-yl)-5-methyloct-4-en-1-amine
CID 123499287
(Z)-3-[(Z)-but-2-en-2-yl]-4-ethenylimino-6-iminohept-2-en-2-amine
CID 132126161
(2E,5E)-N,3-dimethyl-4-methylimino-5-[(propan-2-ylideneamino)methylidene]hepta-2,6-dien-2-amine
CID 134567726
(E)-N'-methylbut-2-ene-1,4-diamine;(2Z)-N-methyl-2-propylidenecyclohexan-1-imine
CID 142416854
(2E,6E)-3,7-dimethyl-10-methyliminoundeca-2,6-dien-1-amine
CID 146254087
5-Methyl-3-prop-2-enyliminohex-4-ene-2,2-diamine
CID 146660614
methyl-[(Z)-4-methylundec-4-en-6-ylidene]azanium
CID 153404287

Frequently Asked Questions

What is the IUPAC name of 1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine?
The IUPAC name of 1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine (CID 123286955) is 1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine.
What is the SMILES notation for 1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine?
The canonical SMILES for 1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine is C=CC(=C)CCCC(/C=C/C)=NC(N)CC.
What is the InChIKey of 1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine?
The InChIKey is UUZHANNKDUJUNE-WTKXWPBNSA-N. The full InChI is InChI=1S/C14H24N2/c1-5-9-13(16-14(15)7-3)11-8-10-12(4)6-2/h5-6,9,14H,2,4,7-8,10-11,15H2,1,3H3/b9-5+,16-13?.
What are the key properties of 1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine?
1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine has a molecular weight of 220.36 g/mol, XLogP of 3.61, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(2E)-8-methylidenedeca-2,9-dien-4-ylidene]amino]propan-1-amine is sourced from PubChem (CID 123286955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).