(2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine

C14H17N — CID 163665755

IUPAC(2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine
SMILESC=C1/C=C(C)\C=C/C=C\C=C/C=C\C1N
InChIInChI=1S/C14H17N/c1-12-9-7-5-3-4-6-8-10-14(15)13(2)11-12/h3-11,14H,2,15H2,1H3/b5-3-,6-4-,9-7-,10-8-,12-11-
InChIKeyIYHPPUPNERUMHC-CFZVIIMFSA-N
MW199.30 g/mol
LogP3.05
Rot. Bonds

About (2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine

(2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine (PubChem CID 163665755) has the molecular formula C14H17N and a molecular weight of 199.30 g/mol. Its IUPAC name is (2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine.

Molecular Properties

Compound Name(2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine
PubChem CID163665755
Molecular FormulaC14H17N
Molecular Weight199.30 g/mol
Exact Mass199.14
IUPAC Name(2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine
SMILESC=C1/C=C(C)\C=C/C=C\C=C/C=C\C1N
InChIInChI=1S/C14H17N/c1-12-9-7-5-3-4-6-8-10-14(15)13(2)11-12/h3-11,14H,2,15H2,1H3/b5-3-,6-4-,9-7-,10-8-,12-11-
InChIKeyIYHPPUPNERUMHC-CFZVIIMFSA-N
XLogP3.05
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine?
The IUPAC name of (2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine (CID 163665755) is (2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine.
What is the SMILES notation for (2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine?
The canonical SMILES for (2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine is C=C1/C=C(C)\C=C/C=C\C=C/C=C\C1N.
What is the InChIKey of (2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine?
The InChIKey is IYHPPUPNERUMHC-CFZVIIMFSA-N. The full InChI is InChI=1S/C14H17N/c1-12-9-7-5-3-4-6-8-10-14(15)13(2)11-12/h3-11,14H,2,15H2,1H3/b5-3-,6-4-,9-7-,10-8-,12-11-.
What are the key properties of (2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine?
(2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine has a molecular weight of 199.30 g/mol, XLogP of 3.05, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4Z,6Z,8Z,10Z)-10-methyl-12-methylidenecyclododeca-2,4,6,8,10-pentaen-1-amine is sourced from PubChem (CID 163665755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).