N-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine

C13H14N2S — CID 63221653

IUPACN-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine
SMILESc1csc(CNc2ccc3c(c2)CCC3)n1
InChIInChI=1S/C13H14N2S/c1-2-10-4-5-12(8-11(10)3-1)15-9-13-14-6-7-16-13/h4-8,15H,1-3,9H2
InChIKeyLUHACAVDPCSHFQ-UHFFFAOYSA-N
MW230.34 g/mol
LogP3.24
Rot. Bonds3

About N-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine

N-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine (PubChem CID 63221653) has the molecular formula C13H14N2S and a molecular weight of 230.34 g/mol. Its IUPAC name is N-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine.

Molecular Properties

Compound NameN-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine
PubChem CID63221653
Molecular FormulaC13H14N2S
Molecular Weight230.34 g/mol
Exact Mass230.09
IUPAC NameN-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine
SMILESc1csc(CNc2ccc3c(c2)CCC3)n1
InChIInChI=1S/C13H14N2S/c1-2-10-4-5-12(8-11(10)3-1)15-9-13-14-6-7-16-13/h4-8,15H,1-3,9H2
InChIKeyLUHACAVDPCSHFQ-UHFFFAOYSA-N
XLogP3.24
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.34
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1-benzofuran-5-amine
CID 63654803
2,3-dihydro-1H-indene;6-N-(1,3-thiazol-2-ylmethyl)-4H-3,1-benzoxazine-2,6-diamine
CID 143951485
2-methyl-4-N-(1,3-thiazol-2-ylmethyl)benzene-1,4-diamine
CID 61283842
2-[(2,3-dihydro-1H-inden-5-ylamino)methyl]-3H-thieno[3,2-d]pyrimidin-4-one
CID 135802912
N-(1,3-thiazol-2-ylmethyl)pyridin-4-amine
CID 61285050
N-[2-[(2,3-dihydro-1H-inden-5-ylamino)methyl]thiophen-3-yl]acetamide
CID 66387299
N-(thiadiazol-4-ylmethyl)-2,3-dihydro-1H-inden-5-amine
CID 43663884
3-(1,3-thiazol-2-ylmethylamino)cyclopent-2-en-1-one
CID 104788357
N-(1,3-thiazol-2-ylmethyl)-1H-indol-5-amine
CID 63655581
N'-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanediamine
CID 115226489
4-(1,3-thiazol-2-ylmethylamino)benzoic acid
CID 62231543
N-[4-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide
CID 63655785

Frequently Asked Questions

What is the IUPAC name of N-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine?
The IUPAC name of N-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine (CID 63221653) is N-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine.
What is the SMILES notation for N-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine?
The canonical SMILES for N-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine is c1csc(CNc2ccc3c(c2)CCC3)n1.
What is the InChIKey of N-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine?
The InChIKey is LUHACAVDPCSHFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2S/c1-2-10-4-5-12(8-11(10)3-1)15-9-13-14-6-7-16-13/h4-8,15H,1-3,9H2.
What are the key properties of N-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine?
N-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine has a molecular weight of 230.34 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-thiazol-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine is sourced from PubChem (CID 63221653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).