(5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine

C14H21N — CID 118973859

IUPAC(5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine
SMILESC=C(/C=C\C)CC(=C)N(C)C(=C)/C=C\C
InChIInChI=1S/C14H21N/c1-7-9-12(3)11-14(5)15(6)13(4)10-8-2/h7-10H,3-5,11H2,1-2,6H3/b9-7-,10-8-
InChIKeyQPNPSFKRARWDMB-XOHWUJONSA-N
MW203.33 g/mol
LogP4.04
Rot. Bonds6

About (5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine

(5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine (PubChem CID 118973859) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is (5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine.

Molecular Properties

Compound Name(5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine
PubChem CID118973859
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name(5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine
SMILESC=C(/C=C\C)CC(=C)N(C)C(=C)/C=C\C
InChIInChI=1S/C14H21N/c1-7-9-12(3)11-14(5)15(6)13(4)10-8-2/h7-10H,3-5,11H2,1-2,6H3/b9-7-,10-8-
InChIKeyQPNPSFKRARWDMB-XOHWUJONSA-N
XLogP4.04
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine with MolForge

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Related Compounds

1-N,3-N-dimethyl-3-N-[(3Z)-penta-1,3-dien-2-yl]-1-N-(trifluoromethyl)but-3-ene-1,3-diamine
CID 162586583
(6Z)-3,5-dimethylideneocta-1,6-diene
CID 142353486
(3Z,5Z)-N-methyl-N-[(3Z)-penta-1,3-dien-2-yl]octa-1,3,5-trien-2-amine
CID 155240504
1,2-dimethyl-3-methylidene-1-[(3Z)-penta-1,3-dien-2-yl]guanidine
CID 166953787
(3E)-N-methyl-N-propan-2-ylpenta-1,3-dien-2-amine
CID 130272029
(5Z)-4-methylidenehepta-1,5-diene
CID 143920725
ethene;(Z)-2-methylidenepent-3-ene-1-thiol
CID 164863550
4-methylidenehepta-1,5-diene
CID 76553064
N-[(Z)-2-methylidenepent-3-enyl]formamide
CID 143724109
(3Z)-N,N-bis(2-methylpropyl)penta-1,3-dien-2-amine
CID 130331308
ethene;(Z)-3-imino-5-methylideneoct-6-en-2-one
CID 145093202
(Z)-N-methyl-4-methylidenehept-5-enamide
CID 142368118

Frequently Asked Questions

What is the IUPAC name of (5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine?
The IUPAC name of (5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine (CID 118973859) is (5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine.
What is the SMILES notation for (5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine?
The canonical SMILES for (5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine is C=C(/C=C\C)CC(=C)N(C)C(=C)/C=C\C.
What is the InChIKey of (5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine?
The InChIKey is QPNPSFKRARWDMB-XOHWUJONSA-N. The full InChI is InChI=1S/C14H21N/c1-7-9-12(3)11-14(5)15(6)13(4)10-8-2/h7-10H,3-5,11H2,1-2,6H3/b9-7-,10-8-.
What are the key properties of (5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine?
(5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine has a molecular weight of 203.33 g/mol, XLogP of 4.04, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-N-methyl-4-methylidene-N-[(3Z)-penta-1,3-dien-2-yl]hepta-1,5-dien-2-amine is sourced from PubChem (CID 118973859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).