N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide

C16H17N3O2 — CID 47032081

IUPACN-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide
SMILESCOc1cc(CNC(=O)N2CCc3ccccc32)ccn1
InChIInChI=1S/C16H17N3O2/c1-21-15-10-12(6-8-17-15)11-18-16(20)19-9-7-13-4-2-3-5-14(13)19/h2-6,8,10H,7,9,11H2,1H3,(H,18,20)
InChIKeyWAIYYSLYXPVJHU-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.36
Rot. Bonds3

About N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide

N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide (PubChem CID 47032081) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide
PubChem CID47032081
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC NameN-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide
SMILESCOc1cc(CNC(=O)N2CCc3ccccc32)ccn1
InChIInChI=1S/C16H17N3O2/c1-21-15-10-12(6-8-17-15)11-18-16(20)19-9-7-13-4-2-3-5-14(13)19/h2-6,8,10H,7,9,11H2,1H3,(H,18,20)
InChIKeyWAIYYSLYXPVJHU-UHFFFAOYSA-N
XLogP2.36
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-[(2-methoxy-4-pyridinyl)methyl]-2-phenylazetidine-1-carboxamide
CID 94052771
N-[(2-methoxy-4-pyridinyl)methyl]morpholine-4-carboxamide
CID 34677256
6-fluoro-N-[[2-(2,2,2-trifluoroethoxy)-4-pyridinyl]methyl]-2,3-dihydroindole-1-carboxamide
CID 171787305
N-(2-methoxyethyl)-2,3-dihydroindole-1-carboxamide
CID 47193672
3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 43046318
4-(2,3-dihydroindole-1-carbonyl)-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109086940
N-[2-(3,4,5-trimethoxyphenyl)ethyl]-2,3-dihydroindole-1-carboxamide
CID 113217130
N-[2-(3-methoxyphenoxy)ethyl]-2,3-dihydroindole-1-carboxamide
CID 112971555
3-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]-3-(trifluoromethyl)azetidine-1-carboxamide
CID 138022504
N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide
CID 18167281
N-[3-(4-methoxyphenyl)propyl]-2,3-dihydroindole-1-carboxamide
CID 60543023
N-[(2-methoxy-4-pyridinyl)methyl]cyclopropanecarboxamide
CID 60715595

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide?
The IUPAC name of N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide (CID 47032081) is N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide is COc1cc(CNC(=O)N2CCc3ccccc32)ccn1.
What is the InChIKey of N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide?
The InChIKey is WAIYYSLYXPVJHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-21-15-10-12(6-8-17-15)11-18-16(20)19-9-7-13-4-2-3-5-14(13)19/h2-6,8,10H,7,9,11H2,1H3,(H,18,20).
What are the key properties of N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide?
N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide has a molecular weight of 283.33 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 47032081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).