4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol

C15H21NO — CID 30983794

IUPAC4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol
SMILESOC1CCC(NC2Cc3ccccc3C2)CC1
InChIInChI=1S/C15H21NO/c17-15-7-5-13(6-8-15)16-14-9-11-3-1-2-4-12(11)10-14/h1-4,13-17H,5-10H2
InChIKeyUSTUAJWEHLZACB-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.05
Rot. Bonds2

About 4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol

4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol (PubChem CID 30983794) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol
PubChem CID30983794
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol
SMILESOC1CCC(NC2Cc3ccccc3C2)CC1
InChIInChI=1S/C15H21NO/c17-15-7-5-13(6-8-15)16-14-9-11-3-1-2-4-12(11)10-14/h1-4,13-17H,5-10H2
InChIKeyUSTUAJWEHLZACB-UHFFFAOYSA-N
XLogP2.05
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol?
The IUPAC name of 4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol (CID 30983794) is 4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol.
What is the SMILES notation for 4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol?
The canonical SMILES for 4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol is OC1CCC(NC2Cc3ccccc3C2)CC1.
What is the InChIKey of 4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol?
The InChIKey is USTUAJWEHLZACB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c17-15-7-5-13(6-8-15)16-14-9-11-3-1-2-4-12(11)10-14/h1-4,13-17H,5-10H2.
What are the key properties of 4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol?
4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol has a molecular weight of 231.34 g/mol, XLogP of 2.05, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydro-1H-inden-2-ylamino)cyclohexan-1-ol is sourced from PubChem (CID 30983794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).