6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide

C19H24N2O2S — CID 70725974

IUPAC6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide
SMILESCOc1cc2c(cc1C(=O)N(C)Cc1csc(C(C)C)n1)CCC2
InChIInChI=1S/C19H24N2O2S/c1-12(2)18-20-15(11-24-18)10-21(3)19(22)16-8-13-6-5-7-14(13)9-17(16)23-4/h8-9,11-12H,5-7,10H2,1-4H3
InChIKeyZWZYUEBDKBVHCR-UHFFFAOYSA-N
MW344.48 g/mol
LogP4.04
Rot. Bonds5

About 6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide

6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide (PubChem CID 70725974) has the molecular formula C19H24N2O2S and a molecular weight of 344.48 g/mol. Its IUPAC name is 6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide.

Molecular Properties

Compound Name6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide
PubChem CID70725974
Molecular FormulaC19H24N2O2S
Molecular Weight344.48 g/mol
Exact Mass344.16
IUPAC Name6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide
SMILESCOc1cc2c(cc1C(=O)N(C)Cc1csc(C(C)C)n1)CCC2
InChIInChI=1S/C19H24N2O2S/c1-12(2)18-20-15(11-24-18)10-21(3)19(22)16-8-13-6-5-7-14(13)9-17(16)23-4/h8-9,11-12H,5-7,10H2,1-4H3
InChIKeyZWZYUEBDKBVHCR-UHFFFAOYSA-N
XLogP4.04
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.48
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-6-oxo-2-propan-2-yl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-1H-pyridine-3-carboxamide
CID 156585739
N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-1H-pyrazole-4-carboxamide
CID 77085626
N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 56722201
N,2-dimethyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-1H-pyridine-4-carboxamide
CID 77085896
1-methoxy-3-[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]amino]propan-2-ol
CID 62016549
1-[[2-[(1S)-1-methoxyethyl]-1,3-thiazol-4-yl]methyl]-1,3,3-trimethylurea
CID 99775487
1-[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]amino]propan-2-ol
CID 62334490
methyl (2S)-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]-4-oxopentanoate;molecular iodine
CID 90705945
methyl (2S)-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]pentanoate
CID 118297816
methyl (2S)-3-methyl-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]pentanoate
CID 59131480
N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
CID 47031583
methyl N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamate
CID 110728086

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide?
The IUPAC name of 6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide (CID 70725974) is 6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide.
What is the SMILES notation for 6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide?
The canonical SMILES for 6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide is COc1cc2c(cc1C(=O)N(C)Cc1csc(C(C)C)n1)CCC2.
What is the InChIKey of 6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide?
The InChIKey is ZWZYUEBDKBVHCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2S/c1-12(2)18-20-15(11-24-18)10-21(3)19(22)16-8-13-6-5-7-14(13)9-17(16)23-4/h8-9,11-12H,5-7,10H2,1-4H3.
What are the key properties of 6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide?
6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide has a molecular weight of 344.48 g/mol, XLogP of 4.04, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-methyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide is sourced from PubChem (CID 70725974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).