N-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide

C17H23NO2 — CID 106893203

IUPACN-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide
SMILESO=C(NC1(CO)CCCCC1)C1Cc2ccccc2C1
InChIInChI=1S/C17H23NO2/c19-12-17(8-4-1-5-9-17)18-16(20)15-10-13-6-2-3-7-14(13)11-15/h2-3,6-7,15,19H,1,4-5,8-12H2,(H,18,20)
InChIKeyPFZFEYIIDVXVHC-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.21
Rot. Bonds3

About N-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide

N-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide (PubChem CID 106893203) has the molecular formula C17H23NO2 and a molecular weight of 273.38 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide
PubChem CID106893203
Molecular FormulaC17H23NO2
Molecular Weight273.38 g/mol
Exact Mass273.17
IUPAC NameN-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide
SMILESO=C(NC1(CO)CCCCC1)C1Cc2ccccc2C1
InChIInChI=1S/C17H23NO2/c19-12-17(8-4-1-5-9-17)18-16(20)15-10-13-6-2-3-7-14(13)11-15/h2-3,6-7,15,19H,1,4-5,8-12H2,(H,18,20)
InChIKeyPFZFEYIIDVXVHC-UHFFFAOYSA-N
XLogP2.21
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(hydroxymethyl)oxan-4-yl]-2,3-dihydro-1H-indene-2-carboxamide
CID 106704048
N-[1-(hydroxymethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901441
N-[1-(bromomethyl)-3-methylcyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide
CID 106894273
N-[1-(hydroxymethyl)cyclobutyl]cycloheptanecarboxamide
CID 115878103
N-[1-(hydroxymethyl)cyclobutyl]cyclopropanecarboxamide
CID 115878461
N-[1-(hydroxymethyl)cyclopropyl]cycloheptanecarboxamide
CID 115764905
N-[1-(hydroxymethyl)cyclohexyl]-1-phenylcyclopropane-1-carboxamide
CID 62521476
2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclohexyl]acetamide
CID 62522014
N-[4-(hydroxymethyl)oxan-4-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 106298865
N-[1-(hydroxymethyl)cyclohexyl]pyrrolidine-3-carboxamide
CID 63006732
N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide
CID 62519112
1-[2-(azepan-1-yl)phenyl]-3-[1-(hydroxymethyl)cyclopentyl]urea
CID 111925944

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide (CID 106893203) is N-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide is O=C(NC1(CO)CCCCC1)C1Cc2ccccc2C1.
What is the InChIKey of N-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide?
The InChIKey is PFZFEYIIDVXVHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO2/c19-12-17(8-4-1-5-9-17)18-16(20)15-10-13-6-2-3-7-14(13)11-15/h2-3,6-7,15,19H,1,4-5,8-12H2,(H,18,20).
What are the key properties of N-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide?
N-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide has a molecular weight of 273.38 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide is sourced from PubChem (CID 106893203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).