N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide

C20H30N4O2 — CID 120647194

IUPACN-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)Nc2ccc3ccn(CCN(C)C)c3c2)CCNCC1
InChIInChI=1S/C20H30N4O2/c1-23(2)12-13-24-11-6-16-4-5-17(14-18(16)24)22-19(25)20(15-26-3)7-9-21-10-8-20/h4-6,11,14,21H,7-10,12-13,15H2,1-3H3,(H,22,25)
InChIKeyPCLBNCCFLODTTJ-UHFFFAOYSA-N
MW358.49 g/mol
LogP2.16
Rot. Bonds7

About N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide

N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide (PubChem CID 120647194) has the molecular formula C20H30N4O2 and a molecular weight of 358.49 g/mol. Its IUPAC name is N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide
PubChem CID120647194
Molecular FormulaC20H30N4O2
Molecular Weight358.49 g/mol
Exact Mass358.24
IUPAC NameN-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)Nc2ccc3ccn(CCN(C)C)c3c2)CCNCC1
InChIInChI=1S/C20H30N4O2/c1-23(2)12-13-24-11-6-16-4-5-17(14-18(16)24)22-19(25)20(15-26-3)7-9-21-10-8-20/h4-6,11,14,21H,7-10,12-13,15H2,1-3H3,(H,22,25)
InChIKeyPCLBNCCFLODTTJ-UHFFFAOYSA-N
XLogP2.16
TPSA58.53 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(methoxymethyl)-N-(1-propylindol-5-yl)piperidine-4-carboxamide
CID 120645454
1-amino-N-[1-[2-(dimethylamino)ethyl]indol-6-yl]cyclopropane-1-carboxamide
CID 119891229
N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-2-(1-hydroxycyclopentyl)acetamide
CID 111539901
N-[3-chloro-4-[2-(dimethylamino)ethoxy]phenyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120645221
2-amino-N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-2-methylpropanamide
CID 119891239
N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-3-piperidin-3-ylbutanamide;dihydrochloride
CID 119891270
4-(aminomethyl)-N-[1-[2-(dimethylamino)ethyl]indol-6-yl]benzamide
CID 119891273
N-[3-(dimethylcarbamoyl)-4-fluorophenyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120635085
N-[4-(dimethylcarbamoyl)phenyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120617739
N-[1-[2-(dimethylamino)ethyl]indol-6-yl]morpholine-3-carboxamide;dihydrochloride
CID 119891236
4-(methoxymethyl)-N-(4-pyrazol-1-ylphenyl)piperidine-4-carboxamide
CID 120619785
N-(2,3-dihydro-1H-inden-5-yl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120616974

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide?
The IUPAC name of N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide (CID 120647194) is N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide.
What is the SMILES notation for N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide?
The canonical SMILES for N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide is COCC1(C(=O)Nc2ccc3ccn(CCN(C)C)c3c2)CCNCC1.
What is the InChIKey of N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide?
The InChIKey is PCLBNCCFLODTTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4O2/c1-23(2)12-13-24-11-6-16-4-5-17(14-18(16)24)22-19(25)20(15-26-3)7-9-21-10-8-20/h4-6,11,14,21H,7-10,12-13,15H2,1-3H3,(H,22,25).
What are the key properties of N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide?
N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide has a molecular weight of 358.49 g/mol, XLogP of 2.16, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-(methoxymethyl)piperidine-4-carboxamide is sourced from PubChem (CID 120647194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).