(1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine

C13H15N — CID 163497639

IUPAC(1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine
SMILESC=C1/C=C\C=C/C=C/C(C)=C\C=C/1N
InChIInChI=1S/C13H15N/c1-11-7-5-3-4-6-8-12(2)13(14)10-9-11/h3-10H,2,14H2,1H3/b4-3-,7-5+,8-6-,11-9-,13-10+
InChIKeyCSBJNYYYELJYOW-HXDSNAGJSA-N
MW185.27 g/mol
LogP3.01
Rot. Bonds

About (1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine

(1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine (PubChem CID 163497639) has the molecular formula C13H15N and a molecular weight of 185.27 g/mol. Its IUPAC name is (1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine.

Molecular Properties

Compound Name(1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine
PubChem CID163497639
Molecular FormulaC13H15N
Molecular Weight185.27 g/mol
Exact Mass185.12
IUPAC Name(1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine
SMILESC=C1/C=C\C=C/C=C/C(C)=C\C=C/1N
InChIInChI=1S/C13H15N/c1-11-7-5-3-4-6-8-12(2)13(14)10-9-11/h3-10H,2,14H2,1H3/b4-3-,7-5+,8-6-,11-9-,13-10+
InChIKeyCSBJNYYYELJYOW-HXDSNAGJSA-N
XLogP3.01
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1Z,3Z,5Z,7Z)-1,3-dimethylcycloocta-1,3,5,7-tetraene
CID 139752949
CID 156594021
CID 156594021
CID 142048626
CID 142048626
1-iodyl-5-methylidenecyclopenta-1,3-diene
CID 140968042
1-hexyl-4-methylcycloocta-1,3,5,7-tetraene
CID 123846771
4-methylcyclohepta-1,3,5-trien-1-amine;molecular hydrogen
CID 143190843
6-methylidenecyclohexa-2,4-diene-1-selone
CID 14249672
(3Z,5Z)-1,2,3,4-tetramethylcycloocta-1,3,5,7-tetraene
CID 173070981
N'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide
CID 129181532
CID 102118032
CID 102118032
methane;6-methylidenecyclohexa-2,4-dien-1-one;2-methylpropane
CID 157497539
5-methyl-6-methylidenecyclohexa-2,4-dien-1-one
CID 13265824

Frequently Asked Questions

What is the IUPAC name of (1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine?
The IUPAC name of (1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine (CID 163497639) is (1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine.
What is the SMILES notation for (1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine?
The canonical SMILES for (1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine is C=C1/C=C\C=C/C=C/C(C)=C\C=C/1N.
What is the InChIKey of (1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine?
The InChIKey is CSBJNYYYELJYOW-HXDSNAGJSA-N. The full InChI is InChI=1S/C13H15N/c1-11-7-5-3-4-6-8-12(2)13(14)10-9-11/h3-10H,2,14H2,1H3/b4-3-,7-5+,8-6-,11-9-,13-10+.
What are the key properties of (1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine?
(1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine has a molecular weight of 185.27 g/mol, XLogP of 3.01, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine is sourced from PubChem (CID 163497639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).