N-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide

C14H19NO — CID 102232792

IUPACN-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide
SMILESCCCCC(=O)N[C@@H]1CCc2ccccc21
InChIInChI=1S/C14H19NO/c1-2-3-8-14(16)15-13-10-9-11-6-4-5-7-12(11)13/h4-7,13H,2-3,8-10H2,1H3,(H,15,16)/t13-/m1/s1
InChIKeyCPQUNOZMVMDELP-CYBMUJFWSA-N
MW217.31 g/mol
LogP2.98
Rot. Bonds4

About N-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide

N-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide (PubChem CID 102232792) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is N-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide.

Molecular Properties

Compound NameN-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide
PubChem CID102232792
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC NameN-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide
SMILESCCCCC(=O)N[C@@H]1CCc2ccccc21
InChIInChI=1S/C14H19NO/c1-2-3-8-14(16)15-13-10-9-11-6-4-5-7-12(11)13/h4-7,13H,2-3,8-10H2,1H3,(H,15,16)/t13-/m1/s1
InChIKeyCPQUNOZMVMDELP-CYBMUJFWSA-N
XLogP2.98
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide?
The IUPAC name of N-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide (CID 102232792) is N-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide.
What is the SMILES notation for N-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide?
The canonical SMILES for N-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide is CCCCC(=O)N[C@@H]1CCc2ccccc21.
What is the InChIKey of N-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide?
The InChIKey is CPQUNOZMVMDELP-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H19NO/c1-2-3-8-14(16)15-13-10-9-11-6-4-5-7-12(11)13/h4-7,13H,2-3,8-10H2,1H3,(H,15,16)/t13-/m1/s1.
What are the key properties of N-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide?
N-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide has a molecular weight of 217.31 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2,3-dihydro-1H-inden-1-yl]pentanamide is sourced from PubChem (CID 102232792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).