N-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide

C15H24N4O2 — CID 17171271

IUPACN-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide
SMILESCCOCCCNC(=O)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C15H24N4O2/c1-2-21-13-5-8-17-15(20)19-11-9-18(10-12-19)14-6-3-4-7-16-14/h3-4,6-7H,2,5,8-13H2,1H3,(H,17,20)
InChIKeyLPPVMIOTRPFSBX-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.34
Rot. Bonds6

About N-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide

N-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide (PubChem CID 17171271) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide
PubChem CID17171271
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide
SMILESCCOCCCNC(=O)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C15H24N4O2/c1-2-21-13-5-8-17-15(20)19-11-9-18(10-12-19)14-6-3-4-7-16-14/h3-4,6-7H,2,5,8-13H2,1H3,(H,17,20)
InChIKeyLPPVMIOTRPFSBX-UHFFFAOYSA-N
XLogP1.34
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-phenoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide
CID 108883277
N-[2-(2-methylphenoxy)ethyl]-4-pyridin-2-ylpiperazine-1-carboxamide
CID 112969794
4-pyridin-2-yl-N-[2-(2,3,6-trimethylphenoxy)ethyl]piperazine-1-carboxamide
CID 112974307
N-[2-(3-fluorophenoxy)ethyl]-4-pyridin-2-ylpiperazine-1-carboxamide
CID 112970343
4-(4-chlorophenyl)-N-(3-ethoxypropyl)piperazine-1-carboxamide
CID 17171276
N'-(4-ethoxybutyl)-N-ethyl-4-pyridin-2-ylpiperazine-1-carboximidamide;hydroiodide
CID 111219436
N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-4-pyridin-2-ylpiperazine-1-carboxamide
CID 121497433
N-(3-ethoxypropyl)-4-(3-methylphenyl)piperazine-1-carboxamide
CID 127565527
4-pyridin-2-yl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]piperazine-1-carboxamide
CID 112974901
N-butyl-3-oxo-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 108941420
N-[2-(2-chloro-4-fluorophenoxy)ethyl]-4-pyridin-2-ylpiperazine-1-carboxamide
CID 112977019
N-[(2-methoxyphenoxy)methyl]-4-pyridin-2-ylpiperazine-1-carboxamide
CID 108892372

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide?
The IUPAC name of N-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide (CID 17171271) is N-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide.
What is the SMILES notation for N-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide?
The canonical SMILES for N-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide is CCOCCCNC(=O)N1CCN(c2ccccn2)CC1.
What is the InChIKey of N-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide?
The InChIKey is LPPVMIOTRPFSBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-2-21-13-5-8-17-15(20)19-11-9-18(10-12-19)14-6-3-4-7-16-14/h3-4,6-7H,2,5,8-13H2,1H3,(H,17,20).
What are the key properties of N-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide?
N-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.34, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxypropyl)-4-pyridin-2-ylpiperazine-1-carboxamide is sourced from PubChem (CID 17171271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).