2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide

C18H33N3O — CID 120903296

IUPAC2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide
SMILESCC1(CN2CCC(NC(=O)CC3CCCC3)CC2)CCNC1
InChIInChI=1S/C18H33N3O/c1-18(8-9-19-13-18)14-21-10-6-16(7-11-21)20-17(22)12-15-4-2-3-5-15/h15-16,19H,2-14H2,1H3,(H,20,22)
InChIKeyCINHEHCETHJUOA-UHFFFAOYSA-N
MW307.48 g/mol
LogP2.15
Rot. Bonds5

About 2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide

2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide (PubChem CID 120903296) has the molecular formula C18H33N3O and a molecular weight of 307.48 g/mol. Its IUPAC name is 2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide
PubChem CID120903296
Molecular FormulaC18H33N3O
Molecular Weight307.48 g/mol
Exact Mass307.26
IUPAC Name2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide
SMILESCC1(CN2CCC(NC(=O)CC3CCCC3)CC2)CCNC1
InChIInChI=1S/C18H33N3O/c1-18(8-9-19-13-18)14-21-10-6-16(7-11-21)20-17(22)12-15-4-2-3-5-15/h15-16,19H,2-14H2,1H3,(H,20,22)
InChIKeyCINHEHCETHJUOA-UHFFFAOYSA-N
XLogP2.15
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.48
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]cyclohexanecarboxamide
CID 120903015
2-cyclohexyl-1-[4-[(3-methylpyrrolidin-3-yl)methyl]piperazin-1-yl]ethanone
CID 120903102
N-(4-methylcyclohexyl)-2-[4-[(3-methylpyrrolidin-3-yl)methyl]piperazin-1-yl]acetamide;hydrochloride
CID 120899912
ethyl 2-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetate
CID 120898616
1-(4-ethylpiperazin-1-yl)-2-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]ethanone
CID 120900089
2-cyclohexyl-N-[1-(3-fluoropyrrolidine-3-carbonyl)piperidin-4-yl]acetamide;hydrochloride
CID 119042660
N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]acetamide;hydrochloride
CID 120898475
2,2-dimethyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]propanamide;hydrochloride
CID 120899846
1-[(3-methylpyrrolidin-3-yl)methyl]-4-pyrrolidin-1-ylsulfonylpiperidine
CID 120905754
N-[[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methyl]acetamide
CID 120897218
2-cyclopentyl-N-[1-(3-methylbut-2-enyl)piperidin-4-yl]acetamide
CID 122157562
2-cyclopentyl-N-pyrrolidin-3-ylacetamide
CID 60778008

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide?
The IUPAC name of 2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide (CID 120903296) is 2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide.
What is the SMILES notation for 2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide?
The canonical SMILES for 2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide is CC1(CN2CCC(NC(=O)CC3CCCC3)CC2)CCNC1.
What is the InChIKey of 2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide?
The InChIKey is CINHEHCETHJUOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N3O/c1-18(8-9-19-13-18)14-21-10-6-16(7-11-21)20-17(22)12-15-4-2-3-5-15/h15-16,19H,2-14H2,1H3,(H,20,22).
What are the key properties of 2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide?
2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide has a molecular weight of 307.48 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 120903296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).