N-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine

C15H18N2S — CID 104585038

IUPACN-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine
SMILESCC(CNC1Cc2ccccc2C1)c1nccs1
InChIInChI=1S/C15H18N2S/c1-11(15-16-6-7-18-15)10-17-14-8-12-4-2-3-5-13(12)9-14/h2-7,11,14,17H,8-10H2,1H3
InChIKeyRQRGIGRNPAGVDQ-UHFFFAOYSA-N
MW258.39 g/mol
LogP3.00
Rot. Bonds4

About N-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine

N-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine (PubChem CID 104585038) has the molecular formula C15H18N2S and a molecular weight of 258.39 g/mol. Its IUPAC name is N-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound NameN-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine
PubChem CID104585038
Molecular FormulaC15H18N2S
Molecular Weight258.39 g/mol
Exact Mass258.12
IUPAC NameN-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine
SMILESCC(CNC1Cc2ccccc2C1)c1nccs1
InChIInChI=1S/C15H18N2S/c1-11(15-16-6-7-18-15)10-17-14-8-12-4-2-3-5-13(12)9-14/h2-7,11,14,17H,8-10H2,1H3
InChIKeyRQRGIGRNPAGVDQ-UHFFFAOYSA-N
XLogP3.00
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.39
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-methoxy-N-[2-(1,3-thiazol-2-yl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 104584935
N-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine
CID 104584992
4-[2-(1,3-thiazol-2-yl)propylamino]piperidine-1-carboxamide
CID 104584924
(6S)-6-methyl-N-[2-(1,3-thiazol-2-yl)propyl]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-amine
CID 104585069
N-[2-(1,3-thiazol-2-yl)propyl]pyrimidin-2-amine
CID 104577139
5-fluoro-N-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-1-amine
CID 104584945
N-[cyclopropyl(thiophen-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-1-amine
CID 104584966
1-phenyl-N-[2-(1,3-thiazol-2-yl)propyl]propan-1-amine
CID 113429643
9-methyl-N-[2-(1,3-thiazol-2-yl)propyl]-2,3,4,5-tetrahydro-1-benzoxepin-5-amine
CID 104585119
2-(1,3-thiazol-2-yl)-N-(thiophen-2-ylmethyl)propan-1-amine
CID 104588791
1-cyclopropyl-N-[2-(1,3-thiazol-2-yl)propyl]propan-2-amine
CID 104584982
2-hydroxy-N-[2-(1,3-thiazol-2-yl)propyl]benzamide
CID 113428975

Frequently Asked Questions

What is the IUPAC name of N-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of N-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine (CID 104585038) is N-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for N-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for N-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine is CC(CNC1Cc2ccccc2C1)c1nccs1.
What is the InChIKey of N-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine?
The InChIKey is RQRGIGRNPAGVDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2S/c1-11(15-16-6-7-18-15)10-17-14-8-12-4-2-3-5-13(12)9-14/h2-7,11,14,17H,8-10H2,1H3.
What are the key properties of N-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine?
N-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine has a molecular weight of 258.39 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 104585038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).