N-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine

C20H21N3 — CID 142645958

IUPACN-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCN(C1=NCCN1)C1CC2c3ccccc3C1c1ccccc12
InChIInChI=1S/C20H21N3/c1-23(20-21-10-11-22-20)18-12-17-13-6-2-4-8-15(13)19(18)16-9-5-3-7-14(16)17/h2-9,17-19H,10-12H2,1H3,(H,21,22)
InChIKeyIHZBBKOERJEMFD-UHFFFAOYSA-N
MW303.41 g/mol
LogP2.93
Rot. Bonds1

About N-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine

N-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 142645958) has the molecular formula C20H21N3 and a molecular weight of 303.41 g/mol. Its IUPAC name is N-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID142645958
Molecular FormulaC20H21N3
Molecular Weight303.41 g/mol
Exact Mass303.17
IUPAC NameN-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCN(C1=NCCN1)C1CC2c3ccccc3C1c1ccccc12
InChIInChI=1S/C20H21N3/c1-23(20-21-10-11-22-20)18-12-17-13-6-2-4-8-15(13)19(18)16-9-5-3-7-14(16)17/h2-9,17-19H,10-12H2,1H3,(H,21,22)
InChIKeyIHZBBKOERJEMFD-UHFFFAOYSA-N
XLogP2.93
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-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

ethane;2-(1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole
CID 91000724
4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 114400584
N-(2,6-dichlorophenyl)-N-phenyl-4,5-dihydro-1H-imidazol-2-amine
CID 10913785
N-methyl-N-[(3-methylcyclobutyl)methyl]-4,5-dihydro-1H-imidazol-2-amine
CID 164652839
molecular hydrogen;2-(2-phenylcyclopropyl)-4,5-dihydro-1H-imidazole
CID 145111128
[(15S)-15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl]methyl propanoate
CID 163144385
1-(4,5-dihydro-1H-imidazol-2-yl)-1,3-dihydroisoindol-2-amine
CID 19881180
N-methyl-N-[(Z)-naphthalen-2-ylmethylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydroiodide
CID 6519025
N-(3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazol-2-amine
CID 58361122
1-[2-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-N,N-dimethylmethanamine
CID 82241351
2-[(2-cyclopropylphenyl)methoxy]-4,5-dihydro-1H-imidazole
CID 45487957
imino(dioxido)azanium;2-(1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole
CID 22388703

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine (CID 142645958) is N-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine is CN(C1=NCCN1)C1CC2c3ccccc3C1c1ccccc12.
What is the InChIKey of N-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is IHZBBKOERJEMFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3/c1-23(20-21-10-11-22-20)18-12-17-13-6-2-4-8-15(13)19(18)16-9-5-3-7-14(16)17/h2-9,17-19H,10-12H2,1H3,(H,21,22).
What are the key properties of N-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine?
N-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 303.41 g/mol, XLogP of 2.93, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 142645958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).