N-(2-methylcyclopentyl)-2H-benzotriazol-5-amine

C12H16N4 — CID 115770495

IUPACN-(2-methylcyclopentyl)-2H-benzotriazol-5-amine
SMILESCC1CCCC1Nc1ccc2n[nH]nc2c1
InChIInChI=1S/C12H16N4/c1-8-3-2-4-10(8)13-9-5-6-11-12(7-9)15-16-14-11/h5-8,10,13H,2-4H2,1H3,(H,14,15,16)
InChIKeyVGCSICICGOZDHZ-UHFFFAOYSA-N
MW216.29 g/mol
LogP2.56
Rot. Bonds2

About N-(2-methylcyclopentyl)-2H-benzotriazol-5-amine

N-(2-methylcyclopentyl)-2H-benzotriazol-5-amine (PubChem CID 115770495) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is N-(2-methylcyclopentyl)-2H-benzotriazol-5-amine.

Molecular Properties

Compound NameN-(2-methylcyclopentyl)-2H-benzotriazol-5-amine
PubChem CID115770495
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC NameN-(2-methylcyclopentyl)-2H-benzotriazol-5-amine
SMILESCC1CCCC1Nc1ccc2n[nH]nc2c1
InChIInChI=1S/C12H16N4/c1-8-3-2-4-10(8)13-9-5-6-11-12(7-9)15-16-14-11/h5-8,10,13H,2-4H2,1H3,(H,14,15,16)
InChIKeyVGCSICICGOZDHZ-UHFFFAOYSA-N
XLogP2.56
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-methylcyclopentyl)-2H-benzotriazol-5-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-fluoro-N-[(1R,2S)-2-methylcyclopentyl]aniline
CID 96923123
4-methyl-1-N-(2-methylcyclopentyl)benzene-1,3-diamine
CID 63278049
4-(2H-benzotriazol-5-ylamino)cyclohexan-1-ol
CID 102049748
N-(2-methylcyclopentyl)pyridin-4-amine
CID 63281266
4-N-(2-methylcyclohexyl)benzene-1,2,4-triamine
CID 106750255
2-chloro-4-[(2-methylcyclopentyl)amino]phenol
CID 107678036
4-[(2-methylcyclopentyl)amino]benzene-1,2-dicarbonitrile
CID 107788162
3,5-difluoro-N-[(1R,2S)-2-methylcyclopentyl]aniline
CID 96923141
N-(2-methylcyclopentyl)pyrimidin-5-amine
CID 107587748
5-[(2-methylcyclopentyl)amino]-3H-1,3-benzoxazol-2-one
CID 65044585
3-(methoxymethyl)-N-(2-methylcyclopentyl)aniline
CID 65044502
3-methoxy-N-[(1S,2S)-2-methylcyclopentyl]aniline
CID 96923143

Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclopentyl)-2H-benzotriazol-5-amine?
The IUPAC name of N-(2-methylcyclopentyl)-2H-benzotriazol-5-amine (CID 115770495) is N-(2-methylcyclopentyl)-2H-benzotriazol-5-amine.
What is the SMILES notation for N-(2-methylcyclopentyl)-2H-benzotriazol-5-amine?
The canonical SMILES for N-(2-methylcyclopentyl)-2H-benzotriazol-5-amine is CC1CCCC1Nc1ccc2n[nH]nc2c1.
What is the InChIKey of N-(2-methylcyclopentyl)-2H-benzotriazol-5-amine?
The InChIKey is VGCSICICGOZDHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-8-3-2-4-10(8)13-9-5-6-11-12(7-9)15-16-14-11/h5-8,10,13H,2-4H2,1H3,(H,14,15,16).
What are the key properties of N-(2-methylcyclopentyl)-2H-benzotriazol-5-amine?
N-(2-methylcyclopentyl)-2H-benzotriazol-5-amine has a molecular weight of 216.29 g/mol, XLogP of 2.56, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclopentyl)-2H-benzotriazol-5-amine is sourced from PubChem (CID 115770495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).