N-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline

C14H15N5O — CID 43734008

IUPACN-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline
SMILESCc1nnnn1-c1cccc(NC(C)c2ccco2)c1
InChIInChI=1S/C14H15N5O/c1-10(14-7-4-8-20-14)15-12-5-3-6-13(9-12)19-11(2)16-17-18-19/h3-10,15H,1-2H3
InChIKeyHSNWKEANPNMEHZ-UHFFFAOYSA-N
MW269.31 g/mol
LogP2.74
Rot. Bonds4

About N-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline

N-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline (PubChem CID 43734008) has the molecular formula C14H15N5O and a molecular weight of 269.31 g/mol. Its IUPAC name is N-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline.

Molecular Properties

Compound NameN-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline
PubChem CID43734008
Molecular FormulaC14H15N5O
Molecular Weight269.31 g/mol
Exact Mass269.13
IUPAC NameN-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline
SMILESCc1nnnn1-c1cccc(NC(C)c2ccco2)c1
InChIInChI=1S/C14H15N5O/c1-10(14-7-4-8-20-14)15-12-5-3-6-13(9-12)19-11(2)16-17-18-19/h3-10,15H,1-2H3
InChIKeyHSNWKEANPNMEHZ-UHFFFAOYSA-N
XLogP2.74
TPSA68.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.31
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-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-[1-(furan-2-yl)propyl]-3-(5-methyltetrazol-1-yl)aniline
CID 62633991
N-[1-(furan-2-yl)ethyl]-3-(1,2,4-triazol-4-yl)aniline
CID 43692009
N-[1-(5-chlorothiophen-3-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline
CID 102976943
N-[1-(furan-2-yl)ethyl]-3-pyrrolidin-1-ylaniline
CID 54863773
3-(5-methyltetrazol-1-yl)-N-prop-2-ynylaniline
CID 63951883
N-(2-methylbutyl)-3-(5-methyltetrazol-1-yl)aniline
CID 43733948
N-[(3-methylfuran-2-yl)methyl]-3-(5-methyltetrazol-1-yl)aniline
CID 115744001
N-[1-(furan-2-yl)ethyl]-1-methyltetrazol-5-amine
CID 63152502
[3-(5-methyltetrazol-1-yl)phenyl]thiourea
CID 169356763
3-N-[1-(furan-2-yl)ethyl]benzene-1,3-diamine
CID 43535637
(2S)-2-amino-3-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]butanamide
CID 61178099
2-methylsulfanyl-N-[3-(5-methyltetrazol-1-yl)phenyl]propanamide
CID 47329361

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline?
The IUPAC name of N-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline (CID 43734008) is N-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline.
What is the SMILES notation for N-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline?
The canonical SMILES for N-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline is Cc1nnnn1-c1cccc(NC(C)c2ccco2)c1.
What is the InChIKey of N-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline?
The InChIKey is HSNWKEANPNMEHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O/c1-10(14-7-4-8-20-14)15-12-5-3-6-13(9-12)19-11(2)16-17-18-19/h3-10,15H,1-2H3.
What are the key properties of N-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline?
N-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline has a molecular weight of 269.31 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)ethyl]-3-(5-methyltetrazol-1-yl)aniline is sourced from PubChem (CID 43734008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).