N-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline

C14H15N5O — CID 62346303

IUPACN-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline
SMILESCCc1ccc(CNc2ccc(-n3cnnn3)cc2)o1
InChIInChI=1S/C14H15N5O/c1-2-13-7-8-14(20-13)9-15-11-3-5-12(6-4-11)19-10-16-17-18-19/h3-8,10,15H,2,9H2,1H3
InChIKeyPANPLVWRPNRNSO-UHFFFAOYSA-N
MW269.31 g/mol
LogP2.43
Rot. Bonds5

About N-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline

N-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline (PubChem CID 62346303) has the molecular formula C14H15N5O and a molecular weight of 269.31 g/mol. Its IUPAC name is N-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline.

Molecular Properties

Compound NameN-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline
PubChem CID62346303
Molecular FormulaC14H15N5O
Molecular Weight269.31 g/mol
Exact Mass269.13
IUPAC NameN-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline
SMILESCCc1ccc(CNc2ccc(-n3cnnn3)cc2)o1
InChIInChI=1S/C14H15N5O/c1-2-13-7-8-14(20-13)9-15-11-3-5-12(6-4-11)19-10-16-17-18-19/h3-8,10,15H,2,9H2,1H3
InChIKeyPANPLVWRPNRNSO-UHFFFAOYSA-N
XLogP2.43
TPSA68.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.31
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline 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-[(5-ethylfuran-2-yl)methyl]-2-fluoro-5-(tetrazol-1-yl)aniline
CID 62346177
N-[(5-ethylfuran-2-yl)methyl]-4-(1,2,4-triazol-1-yl)aniline
CID 62345471
N-[(2-ethylpyrazol-3-yl)methyl]-4-(tetrazol-1-yl)aniline
CID 115762701
N-[(2-propylpyrazol-3-yl)methyl]-4-(tetrazol-1-yl)aniline
CID 114554811
N-(2-methylpropyl)-4-(tetrazol-1-yl)aniline
CID 28621711
4-[[4-(tetrazol-1-yl)anilino]methyl]phenol
CID 28621639
N-[(5-ethylfuran-2-yl)methyl]-4-(1,3,4-oxadiazol-2-yl)aniline
CID 62346309
N-[(2-methyl-1H-imidazol-5-yl)methyl]-4-(tetrazol-1-yl)aniline
CID 62741215
N-[(5-methyl-1H-imidazol-4-yl)methyl]-4-(tetrazol-1-yl)aniline
CID 55114541
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-4-(tetrazol-1-yl)aniline
CID 28781201
N-[(5-chlorofuran-2-yl)methyl]-4-methyl-3-(tetrazol-1-yl)aniline
CID 60780934
2-methyl-2-[[4-(tetrazol-1-yl)anilino]methyl]butan-1-ol
CID 81411606

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline?
The IUPAC name of N-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline (CID 62346303) is N-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline.
What is the SMILES notation for N-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline?
The canonical SMILES for N-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline is CCc1ccc(CNc2ccc(-n3cnnn3)cc2)o1.
What is the InChIKey of N-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline?
The InChIKey is PANPLVWRPNRNSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O/c1-2-13-7-8-14(20-13)9-15-11-3-5-12(6-4-11)19-10-16-17-18-19/h3-8,10,15H,2,9H2,1H3.
What are the key properties of N-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline?
N-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline has a molecular weight of 269.31 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethylfuran-2-yl)methyl]-4-(tetrazol-1-yl)aniline is sourced from PubChem (CID 62346303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).