N-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide

C19H33N3O2 — CID 95335426

IUPACN-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide
SMILESO=C(CN1CCCC[C@@H]1CN1CCCC1=O)NCC1CCCCC1
InChIInChI=1S/C19H33N3O2/c23-18(20-13-16-7-2-1-3-8-16)15-21-11-5-4-9-17(21)14-22-12-6-10-19(22)24/h16-17H,1-15H2,(H,20,23)/t17-/m1/s1
InChIKeyKPYLMFSBDSYWKP-QGZVFWFLSA-N
MW335.49 g/mol
LogP2.16
Rot. Bonds6

About N-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide

N-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide (PubChem CID 95335426) has the molecular formula C19H33N3O2 and a molecular weight of 335.49 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide
PubChem CID95335426
Molecular FormulaC19H33N3O2
Molecular Weight335.49 g/mol
Exact Mass335.26
IUPAC NameN-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide
SMILESO=C(CN1CCCC[C@@H]1CN1CCCC1=O)NCC1CCCCC1
InChIInChI=1S/C19H33N3O2/c23-18(20-13-16-7-2-1-3-8-16)15-21-11-5-4-9-17(21)14-22-12-6-10-19(22)24/h16-17H,1-15H2,(H,20,23)/t17-/m1/s1
InChIKeyKPYLMFSBDSYWKP-QGZVFWFLSA-N
XLogP2.16
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.49
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide?
The IUPAC name of N-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide (CID 95335426) is N-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide.
What is the SMILES notation for N-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide?
The canonical SMILES for N-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide is O=C(CN1CCCC[C@@H]1CN1CCCC1=O)NCC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide?
The InChIKey is KPYLMFSBDSYWKP-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H33N3O2/c23-18(20-13-16-7-2-1-3-8-16)15-21-11-5-4-9-17(21)14-22-12-6-10-19(22)24/h16-17H,1-15H2,(H,20,23)/t17-/m1/s1.
What are the key properties of N-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide?
N-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide has a molecular weight of 335.49 g/mol, XLogP of 2.16, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-2-[(2R)-2-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]acetamide is sourced from PubChem (CID 95335426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).