N-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine

C13H17N5 — CID 103736960

IUPACN-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine
SMILESCC1(CNc2nnnn2-c2ccccc2)CCC1
InChIInChI=1S/C13H17N5/c1-13(8-5-9-13)10-14-12-15-16-17-18(12)11-6-3-2-4-7-11/h2-4,6-7H,5,8-10H2,1H3,(H,14,15,17)
InChIKeyRSUBLIUEVMJNGO-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.26
Rot. Bonds4

About N-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine

N-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine (PubChem CID 103736960) has the molecular formula C13H17N5 and a molecular weight of 243.31 g/mol. Its IUPAC name is N-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine.

Molecular Properties

Compound NameN-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine
PubChem CID103736960
Molecular FormulaC13H17N5
Molecular Weight243.31 g/mol
Exact Mass243.15
IUPAC NameN-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine
SMILESCC1(CNc2nnnn2-c2ccccc2)CCC1
InChIInChI=1S/C13H17N5/c1-13(8-5-9-13)10-14-12-15-16-17-18(12)11-6-3-2-4-7-11/h2-4,6-7H,5,8-10H2,1H3,(H,14,15,17)
InChIKeyRSUBLIUEVMJNGO-UHFFFAOYSA-N
XLogP2.26
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-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

N-[[1-(dimethylamino)cycloheptyl]methyl]-1-phenyltetrazol-5-amine
CID 17418964
2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol
CID 133376008
N-[(4-methoxyoxan-4-yl)methyl]-1-phenyltetrazol-5-amine
CID 133400034
N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-1-phenyltetrazol-5-amine
CID 133459238
N-[(1-methylcyclopentyl)methyl]-1-phenylimidazol-2-amine
CID 106572301
N-[(2-aminocyclohexyl)methyl]-1-phenyltetrazol-5-amine
CID 64927678
N-[(1-methylpyrrolidin-2-yl)methyl]-1-phenyltetrazol-5-amine
CID 106026908
N'-(1-phenyltetrazol-5-yl)propane-1,3-diamine
CID 24707793
N-[(3-aminocyclobutyl)methyl]-1-phenyltetrazol-5-amine
CID 66007158
1-phenyl-2-(1-phenyltetrazol-5-yl)hydrazine
CID 134909651
N-[(1-methylpyrrolidin-3-yl)methyl]-1-phenyltetrazol-5-amine
CID 60855788
2-[1-[(1-phenyltetrazol-5-yl)amino]cyclopentyl]acetic acid
CID 64700964

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine?
The IUPAC name of N-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine (CID 103736960) is N-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine.
What is the SMILES notation for N-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine?
The canonical SMILES for N-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine is CC1(CNc2nnnn2-c2ccccc2)CCC1.
What is the InChIKey of N-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine?
The InChIKey is RSUBLIUEVMJNGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5/c1-13(8-5-9-13)10-14-12-15-16-17-18(12)11-6-3-2-4-7-11/h2-4,6-7H,5,8-10H2,1H3,(H,14,15,17).
What are the key properties of N-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine?
N-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine has a molecular weight of 243.31 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine is sourced from PubChem (CID 103736960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).