4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide

C16H24N2O — CID 71040351

IUPAC4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide
SMILESNC1CCC(C(=O)NC2C=C3CCCC3=CC2)CC1
InChIInChI=1S/C16H24N2O/c17-14-7-4-12(5-8-14)16(19)18-15-9-6-11-2-1-3-13(11)10-15/h6,10,12,14-15H,1-5,7-9,17H2,(H,18,19)
InChIKeyCSPAGIPXTFXSON-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.43
Rot. Bonds2

About 4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide

4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide (PubChem CID 71040351) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide
PubChem CID71040351
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide
SMILESNC1CCC(C(=O)NC2C=C3CCCC3=CC2)CC1
InChIInChI=1S/C16H24N2O/c17-14-7-4-12(5-8-14)16(19)18-15-9-6-11-2-1-3-13(11)10-15/h6,10,12,14-15H,1-5,7-9,17H2,(H,18,19)
InChIKeyCSPAGIPXTFXSON-UHFFFAOYSA-N
XLogP2.43
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide?
The IUPAC name of 4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide (CID 71040351) is 4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide is NC1CCC(C(=O)NC2C=C3CCCC3=CC2)CC1.
What is the InChIKey of 4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide?
The InChIKey is CSPAGIPXTFXSON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c17-14-7-4-12(5-8-14)16(19)18-15-9-6-11-2-1-3-13(11)10-15/h6,10,12,14-15H,1-5,7-9,17H2,(H,18,19).
What are the key properties of 4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide?
4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide has a molecular weight of 260.38 g/mol, XLogP of 2.43, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2,3,5,6-tetrahydro-1H-inden-5-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 71040351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).