N-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline

C15H19N3O — CID 43675505

IUPACN-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline
SMILESCc1nnc(-c2ccccc2NC(C)C2(C)CC2)o1
InChIInChI=1S/C15H19N3O/c1-10(15(3)8-9-15)16-13-7-5-4-6-12(13)14-18-17-11(2)19-14/h4-7,10,16H,8-9H2,1-3H3
InChIKeyLGWDLAQJJPICAE-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.65
Rot. Bonds4

About N-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline

N-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline (PubChem CID 43675505) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline.

Molecular Properties

Compound NameN-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline
PubChem CID43675505
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline
SMILESCc1nnc(-c2ccccc2NC(C)C2(C)CC2)o1
InChIInChI=1S/C15H19N3O/c1-10(15(3)8-9-15)16-13-7-5-4-6-12(13)14-18-17-11(2)19-14/h4-7,10,16H,8-9H2,1-3H3
InChIKeyLGWDLAQJJPICAE-UHFFFAOYSA-N
XLogP3.65
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-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

2-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[1-(3-methylthiophen-2-yl)ethyl]aniline
CID 63992639
2-iodo-N-[1-(1-methylcyclopropyl)ethyl]aniline
CID 43173505
N-(2-methylbutyl)-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline
CID 43675457
1-chloro-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]methanesulfonamide
CID 63666407
N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thian-4-amine
CID 43675543
N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 56812846
3-amino-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]oxolane-3-carboxamide
CID 64892717
1-bromo-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]methanesulfonamide
CID 83084278
N-(3,4-dimethylcyclohexyl)-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline
CID 64733940
(2S,3S)-2-amino-3-methyl-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pentanamide
CID 61155830
N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 78982597
3-amino-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide
CID 43700063

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline?
The IUPAC name of N-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline (CID 43675505) is N-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline.
What is the SMILES notation for N-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline?
The canonical SMILES for N-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline is Cc1nnc(-c2ccccc2NC(C)C2(C)CC2)o1.
What is the InChIKey of N-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline?
The InChIKey is LGWDLAQJJPICAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-10(15(3)8-9-15)16-13-7-5-4-6-12(13)14-18-17-11(2)19-14/h4-7,10,16H,8-9H2,1-3H3.
What are the key properties of N-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline?
N-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline has a molecular weight of 257.34 g/mol, XLogP of 3.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-methylcyclopropyl)ethyl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)aniline is sourced from PubChem (CID 43675505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).