N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide

C16H21NO2 — CID 104927094

IUPACN-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide
SMILESO=C(N[C@@H]1CCCC[C@H]1O)c1ccc2c(c1)CCC2
InChIInChI=1S/C16H21NO2/c18-15-7-2-1-6-14(15)17-16(19)13-9-8-11-4-3-5-12(11)10-13/h8-10,14-15,18H,1-7H2,(H,17,19)/t14-,15-/m1/s1
InChIKeyHGEVOKSFYVUEKO-HUUCEWRRSA-N
MW259.35 g/mol
LogP2.21
Rot. Bonds2

About N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide

N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide (PubChem CID 104927094) has the molecular formula C16H21NO2 and a molecular weight of 259.35 g/mol. Its IUPAC name is N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide
PubChem CID104927094
Molecular FormulaC16H21NO2
Molecular Weight259.35 g/mol
Exact Mass259.16
IUPAC NameN-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide
SMILESO=C(N[C@@H]1CCCC[C@H]1O)c1ccc2c(c1)CCC2
InChIInChI=1S/C16H21NO2/c18-15-7-2-1-6-14(15)17-16(19)13-9-8-11-4-3-5-12(11)10-13/h8-10,14-15,18H,1-7H2,(H,17,19)/t14-,15-/m1/s1
InChIKeyHGEVOKSFYVUEKO-HUUCEWRRSA-N
XLogP2.21
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 ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S,2S)-2-hydroxycyclohexyl]-1,2,3,4-tetrahydroisoquinoline-7-carboxamide
CID 107221690
N-[(1S,2R)-2-methylcyclohexyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 9272837
N-(2-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 62360933
N-(2-aminocyclopropyl)-2,3-dihydro-1H-indene-5-carboxamide
CID 43593856
N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 107221941
N-[(1R,2R,3R)-2-hydroxy-3-methoxycyclopentyl]-2,3-dihydro-1H-indene-5-carboxamide
CID 110125194
4-amino-3-hydroxy-N-(2-hydroxycycloheptyl)benzamide
CID 107075912
4-amino-3-bromo-N-[(1S,2S)-2-hydroxycyclohexyl]benzamide
CID 107221679
3-amino-4-chloro-N-[(1R,2R)-2-hydroxycyclohexyl]benzamide
CID 94413683
3-amino-N-[(1R,2R)-2-hydroxycyclohexyl]benzamide
CID 107211397
3-hydroxy-N-(2-hydroxycyclohexyl)-4-methylbenzamide
CID 62367156
N-(2-hydroxycyclohexyl)-4-iodobenzamide
CID 62365415

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide?
The IUPAC name of N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide (CID 104927094) is N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide.
What is the SMILES notation for N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide?
The canonical SMILES for N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide is O=C(N[C@@H]1CCCC[C@H]1O)c1ccc2c(c1)CCC2.
What is the InChIKey of N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide?
The InChIKey is HGEVOKSFYVUEKO-HUUCEWRRSA-N. The full InChI is InChI=1S/C16H21NO2/c18-15-7-2-1-6-14(15)17-16(19)13-9-8-11-4-3-5-12(11)10-13/h8-10,14-15,18H,1-7H2,(H,17,19)/t14-,15-/m1/s1.
What are the key properties of N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide?
N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide has a molecular weight of 259.35 g/mol, XLogP of 2.21, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indene-5-carboxamide is sourced from PubChem (CID 104927094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).