N-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide

C16H21NO2 — CID 77081814

IUPACN-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide
SMILESO=C(NC1CCC(O)CC1)C1CCc2ccccc21
InChIInChI=1S/C16H21NO2/c18-13-8-6-12(7-9-13)17-16(19)15-10-5-11-3-1-2-4-14(11)15/h1-4,12-13,15,18H,5-10H2,(H,17,19)
InChIKeyQXEBHJVRVMQSDK-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.14
Rot. Bonds2

About N-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide

N-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide (PubChem CID 77081814) has the molecular formula C16H21NO2 and a molecular weight of 259.35 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide
PubChem CID77081814
Molecular FormulaC16H21NO2
Molecular Weight259.35 g/mol
Exact Mass259.16
IUPAC NameN-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide
SMILESO=C(NC1CCC(O)CC1)C1CCc2ccccc21
InChIInChI=1S/C16H21NO2/c18-13-8-6-12(7-9-13)17-16(19)15-10-5-11-3-1-2-4-14(11)15/h1-4,12-13,15,18H,5-10H2,(H,17,19)
InChIKeyQXEBHJVRVMQSDK-UHFFFAOYSA-N
XLogP2.14
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2,3-dihydro-1H-indene-1-carbonylamino)cyclohexane-1-carboxylic acid
CID 119229646
cis-(1R,3S)-3-(2,3-dihydro-1H-indene-1-carbonylamino)cyclopentane-1-carboxylic acid
CID 120679080
(1R)-N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2,3-dihydro-1H-indene-1-carboxamide
CID 99949518
2-[(1R)-2,3-dihydro-1H-inden-1-yl]-N-(4-hydroxycyclohexyl)acetamide
CID 98348274
ethyl 4-[[(1R)-2,3-dihydro-1H-indene-1-carbonyl]amino]piperidine-1-carboxylate
CID 99939190
(1R)-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2,3-dihydro-1H-indene-1-carboxamide
CID 95761037
(1S)-N-[1-(thiophen-2-ylmethyl)piperidin-4-yl]-2,3-dihydro-1H-indene-1-carboxamide
CID 99946478
4-(bicyclo[4.2.0]octa-1,3,5-triene-7-carbonylamino)cyclohexane-1-carboxylic acid
CID 66397056
N-(2-hydroxycyclohexyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 62361076
cadmium;bis(2,3-dihydro-1H-indene-1-carboxylic acid)
CID 162540344
3-(2,3-dihydro-1H-indene-1-carbonylamino)butanoic acid
CID 119221067
(2S)-2-(2,3-dihydro-1H-indene-1-carbonylamino)propanoic acid
CID 119238189

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide (CID 77081814) is N-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide is O=C(NC1CCC(O)CC1)C1CCc2ccccc21.
What is the InChIKey of N-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide?
The InChIKey is QXEBHJVRVMQSDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO2/c18-13-8-6-12(7-9-13)17-16(19)15-10-5-11-3-1-2-4-14(11)15/h1-4,12-13,15,18H,5-10H2,(H,17,19).
What are the key properties of N-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide?
N-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide has a molecular weight of 259.35 g/mol, XLogP of 2.14, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indene-1-carboxamide is sourced from PubChem (CID 77081814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).