5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine

C15H16ClNO — CID 115349183

IUPAC5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine
SMILESC[C@@H](NC1Cc2ccc(Cl)cc2C1)c1ccco1
InChIInChI=1S/C15H16ClNO/c1-10(15-3-2-6-18-15)17-14-8-11-4-5-13(16)7-12(11)9-14/h2-7,10,14,17H,8-9H2,1H3/t10-,14?/m1/s1
InChIKeyCDICRTOZSKHXTP-IAPIXIRKSA-N
MW261.75 g/mol
LogP3.75
Rot. Bonds3

About 5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine

5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine (PubChem CID 115349183) has the molecular formula C15H16ClNO and a molecular weight of 261.75 g/mol. Its IUPAC name is 5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound Name5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine
PubChem CID115349183
Molecular FormulaC15H16ClNO
Molecular Weight261.75 g/mol
Exact Mass261.09
IUPAC Name5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine
SMILESC[C@@H](NC1Cc2ccc(Cl)cc2C1)c1ccco1
InChIInChI=1S/C15H16ClNO/c1-10(15-3-2-6-18-15)17-14-8-11-4-5-13(16)7-12(11)9-14/h2-7,10,14,17H,8-9H2,1H3/t10-,14?/m1/s1
InChIKeyCDICRTOZSKHXTP-IAPIXIRKSA-N
XLogP3.75
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.75
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-[(1S)-1-(4-methylphenyl)ethyl]-2,3-dihydro-1H-inden-2-amine
CID 115349151
5-chloro-N-(2-methyl-1-phenylpropyl)-2,3-dihydro-1H-inden-2-amine
CID 115348805
N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine
CID 81403066
N-[(1S)-1-(furan-2-yl)ethyl]-1-methylpiperidin-4-amine
CID 81403796
4-[(5-chloro-2,3-dihydro-1H-inden-2-yl)amino]pentan-2-ol
CID 113376014
methyl (2S)-2-[(5-chloro-2,3-dihydro-1H-inden-2-yl)amino]propanoate
CID 113291777
2-[(5-chloro-2,3-dihydro-1H-inden-2-yl)amino]-3-methylbutanoic acid
CID 113291789
5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine
CID 115348779
N-[(1S)-1-(furan-2-yl)ethyl]oxan-3-amine
CID 81402561
2-[(5-chloro-2,3-dihydro-1H-inden-2-yl)amino]-4-methylpentan-1-ol
CID 81328281
5-chloro-N-(1-methoxy-3-methylbutan-2-yl)-2,3-dihydro-1H-inden-2-amine
CID 81343273
N-[1-(furan-2-yl)ethyl]thiolan-3-amine
CID 43400292

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of 5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine (CID 115349183) is 5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for 5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for 5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine is C[C@@H](NC1Cc2ccc(Cl)cc2C1)c1ccco1.
What is the InChIKey of 5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine?
The InChIKey is CDICRTOZSKHXTP-IAPIXIRKSA-N. The full InChI is InChI=1S/C15H16ClNO/c1-10(15-3-2-6-18-15)17-14-8-11-4-5-13(16)7-12(11)9-14/h2-7,10,14,17H,8-9H2,1H3/t10-,14?/m1/s1.
What are the key properties of 5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine?
5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine has a molecular weight of 261.75 g/mol, XLogP of 3.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 115349183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).