N-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide

C12H23N3O2 — CID 63103670

IUPACN-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide
SMILESCOC1CCCC1NC(=O)C1CNC(C)CN1
InChIInChI=1S/C12H23N3O2/c1-8-6-14-10(7-13-8)12(16)15-9-4-3-5-11(9)17-2/h8-11,13-14H,3-7H2,1-2H3,(H,15,16)
InChIKeyYPHFDSAZOWTOFI-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.38
Rot. Bonds3

About N-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide

N-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide (PubChem CID 63103670) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide
PubChem CID63103670
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide
SMILESCOC1CCCC1NC(=O)C1CNC(C)CN1
InChIInChI=1S/C12H23N3O2/c1-8-6-14-10(7-13-8)12(16)15-9-4-3-5-11(9)17-2/h8-11,13-14H,3-7H2,1-2H3,(H,15,16)
InChIKeyYPHFDSAZOWTOFI-UHFFFAOYSA-N
XLogP-0.38
TPSA62.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide?
The IUPAC name of N-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide (CID 63103670) is N-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide.
What is the SMILES notation for N-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide?
The canonical SMILES for N-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide is COC1CCCC1NC(=O)C1CNC(C)CN1.
What is the InChIKey of N-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide?
The InChIKey is YPHFDSAZOWTOFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-8-6-14-10(7-13-8)12(16)15-9-4-3-5-11(9)17-2/h8-11,13-14H,3-7H2,1-2H3,(H,15,16).
What are the key properties of N-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide?
N-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide has a molecular weight of 241.33 g/mol, XLogP of -0.38, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxycyclopentyl)-5-methylpiperazine-2-carboxamide is sourced from PubChem (CID 63103670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).