N-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide

C14H20N2O3 — CID 106310514

IUPACN-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide
SMILESO=C(NCCCOCCO)c1ccc2c(c1)CCN2
InChIInChI=1S/C14H20N2O3/c17-7-9-19-8-1-5-16-14(18)12-2-3-13-11(10-12)4-6-15-13/h2-3,10,15,17H,1,4-9H2,(H,16,18)
InChIKeyLZXZYIISKGKKCK-UHFFFAOYSA-N
MW264.32 g/mol
LogP0.78
Rot. Bonds7

About N-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide

N-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide (PubChem CID 106310514) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide
PubChem CID106310514
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide
SMILESO=C(NCCCOCCO)c1ccc2c(c1)CCN2
InChIInChI=1S/C14H20N2O3/c17-7-9-19-8-1-5-16-14(18)12-2-3-13-11(10-12)4-6-15-13/h2-3,10,15,17H,1,4-9H2,(H,16,18)
InChIKeyLZXZYIISKGKKCK-UHFFFAOYSA-N
XLogP0.78
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-pentyl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142455
N-pent-4-ynyl-2,3-dihydro-1H-indole-5-carboxamide
CID 106222041
N-(2-acetamidoethyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43552874
N-[2-(2-hydroxyethoxy)ethyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-carboxamide
CID 108784511
N-(2-phenylsulfanylethyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 60976962
N-(4-propan-2-yloxybutyl)-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 106011165
N-(4-morpholin-4-ylbutyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 71051708
N-[2-[ethyl(methyl)amino]ethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 62641149
N-cyclopropyl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142413
N-[2-[di(propan-2-yl)amino]ethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 43325545
N-[2-(oxolan-2-yl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 54917511
N-[2-(2-hydroxyethoxy)ethyl]-2,3-dihydro-1H-indene-5-carboxamide
CID 55024103

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide?
The IUPAC name of N-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide (CID 106310514) is N-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide.
What is the SMILES notation for N-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide?
The canonical SMILES for N-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide is O=C(NCCCOCCO)c1ccc2c(c1)CCN2.
What is the InChIKey of N-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide?
The InChIKey is LZXZYIISKGKKCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c17-7-9-19-8-1-5-16-14(18)12-2-3-13-11(10-12)4-6-15-13/h2-3,10,15,17H,1,4-9H2,(H,16,18).
What are the key properties of N-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide?
N-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide has a molecular weight of 264.32 g/mol, XLogP of 0.78, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-hydroxyethoxy)propyl]-2,3-dihydro-1H-indole-5-carboxamide is sourced from PubChem (CID 106310514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).