N-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide

C17H34N4O2 — CID 120647879

IUPACN-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCCN1CCN(C(C)CNC(=O)C2(COC)CCNCC2)CC1
InChIInChI=1S/C17H34N4O2/c1-4-20-9-11-21(12-10-20)15(2)13-19-16(22)17(14-23-3)5-7-18-8-6-17/h15,18H,4-14H2,1-3H3,(H,19,22)
InChIKeyAPBYRNHPSRNVQH-UHFFFAOYSA-N
MW326.49 g/mol
LogP0.14
Rot. Bonds7

About N-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide

N-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide (PubChem CID 120647879) has the molecular formula C17H34N4O2 and a molecular weight of 326.49 g/mol. Its IUPAC name is N-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide
PubChem CID120647879
Molecular FormulaC17H34N4O2
Molecular Weight326.49 g/mol
Exact Mass326.27
IUPAC NameN-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCCN1CCN(C(C)CNC(=O)C2(COC)CCNCC2)CC1
InChIInChI=1S/C17H34N4O2/c1-4-20-9-11-21(12-10-20)15(2)13-19-16(22)17(14-23-3)5-7-18-8-6-17/h15,18H,4-14H2,1-3H3,(H,19,22)
InChIKeyAPBYRNHPSRNVQH-UHFFFAOYSA-N
XLogP0.14
TPSA56.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.49
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(methoxymethyl)-N-(2-morpholin-4-ylpropyl)piperidine-4-carboxamide
CID 120642361
4-(methoxymethyl)-N-[2-(4-methylpiperidin-1-yl)propyl]piperidine-4-carboxamide;dihydrochloride
CID 120645519
N-ethyl-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120616337
N-[2-(2,3-dihydroindol-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120644013
N-(3-amino-2-hydroxy-3-oxopropyl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 114154115
N-[2-(diethylamino)-4-methylpentyl]-4-(methoxymethyl)piperidine-4-carboxamide;dihydrochloride
CID 120641178
4-(methoxymethyl)-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]piperidine-4-carboxamide
CID 120639875
4-(methoxymethyl)-N-[2-(4-methoxyphenoxy)propyl]piperidine-4-carboxamide
CID 120622626
4-(methoxymethyl)-N-[2-(2-methoxyphenoxy)propyl]piperidine-4-carboxamide
CID 120636259
4-(methoxymethyl)-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]piperidine-4-carboxamide;dihydrochloride
CID 120639874
4-(methoxymethyl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]piperidine-4-carboxamide
CID 120645530
N-[2-(4-fluorophenoxy)propyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120636214

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide?
The IUPAC name of N-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide (CID 120647879) is N-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide.
What is the SMILES notation for N-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide?
The canonical SMILES for N-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide is CCN1CCN(C(C)CNC(=O)C2(COC)CCNCC2)CC1.
What is the InChIKey of N-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide?
The InChIKey is APBYRNHPSRNVQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N4O2/c1-4-20-9-11-21(12-10-20)15(2)13-19-16(22)17(14-23-3)5-7-18-8-6-17/h15,18H,4-14H2,1-3H3,(H,19,22).
What are the key properties of N-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide?
N-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide has a molecular weight of 326.49 g/mol, XLogP of 0.14, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethylpiperazin-1-yl)propyl]-4-(methoxymethyl)piperidine-4-carboxamide is sourced from PubChem (CID 120647879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).