(1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine

C8H12N2 — CID 177055312

IUPAC(1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine
SMILESCC1=C/CC/C=C(N)/N=C\1
InChIInChI=1S/C8H12N2/c1-7-4-2-3-5-8(9)10-6-7/h4-6H,2-3,9H2,1H3/b7-4-,8-5-,10-6-
InChIKeyNLLNMCARYGNUJM-TZCKPHQKSA-N
MW136.20 g/mol
LogP1.60
Rot. Bonds

About (1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine

(1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine (PubChem CID 177055312) has the molecular formula C8H12N2 and a molecular weight of 136.20 g/mol. Its IUPAC name is (1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine.

Molecular Properties

Compound Name(1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine
PubChem CID177055312
Molecular FormulaC8H12N2
Molecular Weight136.20 g/mol
Exact Mass136.10
IUPAC Name(1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine
SMILESCC1=C/CC/C=C(N)/N=C\1
InChIInChI=1S/C8H12N2/c1-7-4-2-3-5-8(9)10-6-7/h4-6H,2-3,9H2,1H3/b7-4-,8-5-,10-6-
InChIKeyNLLNMCARYGNUJM-TZCKPHQKSA-N
XLogP1.60
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.20
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-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

4,5-Di(ethylidene)-3-fluoropyridin-2-amine
CID 123974610
1-[(Z)-[(4E)-5-fluoro-2,3-dimethylidenehepta-4,6-dienylidene]amino]ethenamine
CID 144049148
(6Z)-7-(trifluoromethyl)-4,5-dihydroazocin-2-amine
CID 174004317
7-Ethyl-2-methyl-4,5-dihydroazocine
CID 123163878
2-[(2Z,6Z)-7-ethyl-4,5-dihydroazocin-2-yl]ethanimine
CID 123178485
(Z)-3-N-[(Z)-2-methylbut-2-enylidene]hex-2-ene-1,3-diimine
CID 123358061
(1Z,3Z,5E)-2-methanimidoyl-3-[(Z)-2-(methylideneamino)ethenyl]hepta-1,3,5-trien-1-amine
CID 130329270
3-ethyl-6-propan-2-yl-4H-azepin-2-amine
CID 134485382
(5Z)-5-butan-2-ylidene-4-methyl-4H-pyridin-2-amine
CID 139376478
(4aZ,6Z,8Z,10E)-cycloocta[c]pyridin-3-amine
CID 139482581
ethane;(Z)-2-[[(E)-2-methylhex-2-enylidene]amino]ethenamine
CID 141990584
(2Z,6Z)-7-ethyl-2-methyl-4,5-dihydroazocine
CID 142311159

Frequently Asked Questions

What is the IUPAC name of (1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine?
The IUPAC name of (1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine (CID 177055312) is (1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine.
What is the SMILES notation for (1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine?
The canonical SMILES for (1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine is CC1=C/CC/C=C(N)/N=C\1.
What is the InChIKey of (1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine?
The InChIKey is NLLNMCARYGNUJM-TZCKPHQKSA-N. The full InChI is InChI=1S/C8H12N2/c1-7-4-2-3-5-8(9)10-6-7/h4-6H,2-3,9H2,1H3/b7-4-,8-5-,10-6-.
What are the key properties of (1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine?
(1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine has a molecular weight of 136.20 g/mol, XLogP of 1.60, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,2Z,6Z)-7-methyl-4,5-dihydroazocin-2-amine is sourced from PubChem (CID 177055312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).