(3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate

C17H19N3O3 — CID 68622126

IUPAC(3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate
SMILESCc1noc(C)c1OC(=O)NCCc1c(C)[nH]c2ccccc12
InChIInChI=1S/C17H19N3O3/c1-10-13(14-6-4-5-7-15(14)19-10)8-9-18-17(21)22-16-11(2)20-23-12(16)3/h4-7,19H,8-9H2,1-3H3,(H,18,21)
InChIKeyOSDLQVFIVQVLSM-UHFFFAOYSA-N
MW313.36 g/mol
LogP3.41
Rot. Bonds4

About (3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate

(3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate (PubChem CID 68622126) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is (3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate.

Molecular Properties

Compound Name(3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate
PubChem CID68622126
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC Name(3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate
SMILESCc1noc(C)c1OC(=O)NCCc1c(C)[nH]c2ccccc12
InChIInChI=1S/C17H19N3O3/c1-10-13(14-6-4-5-7-15(14)19-10)8-9-18-17(21)22-16-11(2)20-23-12(16)3/h4-7,19H,8-9H2,1-3H3,(H,18,21)
InChIKeyOSDLQVFIVQVLSM-UHFFFAOYSA-N
XLogP3.41
TPSA80.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Analyze (3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate 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-dimethylfuran-3-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate
CID 68572367
2-(2-methyl-1H-indol-3-yl)ethylcarbamic acid
CID 115171128
N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-oxobutanamide
CID 71492148
N-[2-(2-methyl-1H-indol-3-yl)ethyl]propanamide
CID 110789052
2-methyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]propanamide
CID 110789053
1-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-phenylurea
CID 110775881
5-methyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-1,3-oxazole-2-carboxamide
CID 112529696
2-cyano-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide
CID 115173271
2-chloro-N-[2-(2-methyl-1H-indol-3-yl)ethyl]benzamide
CID 54776329
2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide
CID 115158041
4-(hydroxymethyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]benzamide
CID 54776348
3,5-dimethoxy-N-[2-(2-methyl-1H-indol-3-yl)ethyl]benzamide
CID 110789064

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate?
The IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate (CID 68622126) is (3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate.
What is the SMILES notation for (3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate?
The canonical SMILES for (3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate is Cc1noc(C)c1OC(=O)NCCc1c(C)[nH]c2ccccc12.
What is the InChIKey of (3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate?
The InChIKey is OSDLQVFIVQVLSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c1-10-13(14-6-4-5-7-15(14)19-10)8-9-18-17(21)22-16-11(2)20-23-12(16)3/h4-7,19H,8-9H2,1-3H3,(H,18,21).
What are the key properties of (3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate?
(3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate has a molecular weight of 313.36 g/mol, XLogP of 3.41, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethyl-1,2-oxazol-4-yl) N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbamate is sourced from PubChem (CID 68622126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).