N-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide

C17H20N2O — CID 11572546

IUPACN-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide
SMILESCC(=O)N(Cc1ccc2ccccc2c1)[C@@H]1CCNC1
InChIInChI=1S/C17H20N2O/c1-13(20)19(17-8-9-18-11-17)12-14-6-7-15-4-2-3-5-16(15)10-14/h2-7,10,17-18H,8-9,11-12H2,1H3/t17-/m1/s1
InChIKeyDWBBFNBXAKCWFH-QGZVFWFLSA-N
MW268.36 g/mol
LogP2.55
Rot. Bonds3

About N-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide

N-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide (PubChem CID 11572546) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is N-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide.

Molecular Properties

Compound NameN-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide
PubChem CID11572546
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC NameN-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide
SMILESCC(=O)N(Cc1ccc2ccccc2c1)[C@@H]1CCNC1
InChIInChI=1S/C17H20N2O/c1-13(20)19(17-8-9-18-11-17)12-14-6-7-15-4-2-3-5-16(15)10-14/h2-7,10,17-18H,8-9,11-12H2,1H3/t17-/m1/s1
InChIKeyDWBBFNBXAKCWFH-QGZVFWFLSA-N
XLogP2.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide?
The IUPAC name of N-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide (CID 11572546) is N-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide.
What is the SMILES notation for N-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide?
The canonical SMILES for N-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide is CC(=O)N(Cc1ccc2ccccc2c1)[C@@H]1CCNC1.
What is the InChIKey of N-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide?
The InChIKey is DWBBFNBXAKCWFH-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H20N2O/c1-13(20)19(17-8-9-18-11-17)12-14-6-7-15-4-2-3-5-16(15)10-14/h2-7,10,17-18H,8-9,11-12H2,1H3/t17-/m1/s1.
What are the key properties of N-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide?
N-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide has a molecular weight of 268.36 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(naphthalen-2-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]acetamide is sourced from PubChem (CID 11572546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).