2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide

C19H27N3O2 — CID 51500199

IUPAC2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide
SMILESCCCO[C@H]1CCCN(Cc2cn(CC(N)=O)c3ccccc23)C1
InChIInChI=1S/C19H27N3O2/c1-2-10-24-16-6-5-9-21(13-16)11-15-12-22(14-19(20)23)18-8-4-3-7-17(15)18/h3-4,7-8,12,16H,2,5-6,9-11,13-14H2,1H3,(H2,20,23)/t16-/m0/s1
InChIKeyQJAPKVSCHNOLBQ-INIZCTEOSA-N
MW329.44 g/mol
LogP2.52
Rot. Bonds7

About 2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide

2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide (PubChem CID 51500199) has the molecular formula C19H27N3O2 and a molecular weight of 329.44 g/mol. Its IUPAC name is 2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide.

Molecular Properties

Compound Name2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide
PubChem CID51500199
Molecular FormulaC19H27N3O2
Molecular Weight329.44 g/mol
Exact Mass329.21
IUPAC Name2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide
SMILESCCCO[C@H]1CCCN(Cc2cn(CC(N)=O)c3ccccc23)C1
InChIInChI=1S/C19H27N3O2/c1-2-10-24-16-6-5-9-21(13-16)11-15-12-22(14-19(20)23)18-8-4-3-7-17(15)18/h3-4,7-8,12,16H,2,5-6,9-11,13-14H2,1H3,(H2,20,23)/t16-/m0/s1
InChIKeyQJAPKVSCHNOLBQ-INIZCTEOSA-N
XLogP2.52
TPSA60.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[3-[[(3S)-3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]methyl]indol-1-yl]acetamide
CID 42194573
2-[3-[[(3R,4R)-4-(4-fluorophenyl)-3-hydroxypiperidin-1-yl]methyl]indol-1-yl]acetamide
CID 133121113
3-[(3-propoxypiperidin-1-yl)methyl]furan-2-carbohydrazide
CID 63578962
acetic acid;2-[3-(pyrrolidin-1-ylmethyl)indol-1-yl]acetic acid
CID 46736509
N-propan-2-yl-2-[3-[[(3R)-3-(pyrrolidin-1-ylmethyl)piperidin-1-yl]methyl]indol-1-yl]acetamide
CID 51872410
4-[1-[3-(4-propoxypiperidin-1-yl)propyl]indol-3-yl]butan-2-one
CID 58967679
2-[3-[[4-[2-(3-methoxyphenoxy)ethyl]piperazin-1-yl]methyl]indol-1-yl]acetamide
CID 46967190
2-[3-[[4-(4-cyclopropyltriazol-1-yl)piperidin-1-yl]methyl]indol-1-yl]acetamide
CID 28697267
[5-[(3-propoxypiperidin-1-yl)methyl]furan-2-yl]methanol
CID 112548894
2-[3-(ethylaminomethyl)indol-1-yl]acetamide
CID 66409295
1-[1-[(1-ethylindol-3-yl)methyl]piperidin-3-yl]-N-methylmethanamine
CID 61203945
4-fluoro-2-[(3-propoxypiperidin-1-yl)methyl]phenol
CID 103947572

Frequently Asked Questions

What is the IUPAC name of 2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide?
The IUPAC name of 2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide (CID 51500199) is 2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide.
What is the SMILES notation for 2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide?
The canonical SMILES for 2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide is CCCO[C@H]1CCCN(Cc2cn(CC(N)=O)c3ccccc23)C1.
What is the InChIKey of 2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide?
The InChIKey is QJAPKVSCHNOLBQ-INIZCTEOSA-N. The full InChI is InChI=1S/C19H27N3O2/c1-2-10-24-16-6-5-9-21(13-16)11-15-12-22(14-19(20)23)18-8-4-3-7-17(15)18/h3-4,7-8,12,16H,2,5-6,9-11,13-14H2,1H3,(H2,20,23)/t16-/m0/s1.
What are the key properties of 2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide?
2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide has a molecular weight of 329.44 g/mol, XLogP of 2.52, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[[(3S)-3-propoxypiperidin-1-yl]methyl]indol-1-yl]acetamide is sourced from PubChem (CID 51500199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).