N-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide

C17H26N2O2 — CID 119750679

IUPACN-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide
SMILESCC(CNC(=O)CC1CCCN1)COCc1ccccc1
InChIInChI=1S/C17H26N2O2/c1-14(12-21-13-15-6-3-2-4-7-15)11-19-17(20)10-16-8-5-9-18-16/h2-4,6-7,14,16,18H,5,8-13H2,1H3,(H,19,20)
InChIKeyYQSCRPUNVQWNQL-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.10
Rot. Bonds8

About N-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide

N-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide (PubChem CID 119750679) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide
PubChem CID119750679
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide
SMILESCC(CNC(=O)CC1CCCN1)COCc1ccccc1
InChIInChI=1S/C17H26N2O2/c1-14(12-21-13-15-6-3-2-4-7-15)11-19-17(20)10-16-8-5-9-18-16/h2-4,6-7,14,16,18H,5,8-13H2,1H3,(H,19,20)
InChIKeyYQSCRPUNVQWNQL-UHFFFAOYSA-N
XLogP2.10
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-phenoxypropyl)-2-pyrrolidin-2-ylacetamide
CID 119734660
N-(3-methoxy-2-methylpropyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119752490
N-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide
CID 119885733
N-(2-phenylsulfanylpropyl)-2-pyrrolidin-2-ylacetamide
CID 119804444
N-(2,3-diphenylpropyl)-2-pyrrolidin-2-ylacetamide
CID 119803974
3-methyl-4-[(2-pyrrolidin-2-ylacetyl)amino]butanoic acid
CID 81073110
N-[2-(dimethylamino)-2-phenylethyl]-2-pyrrolidin-2-ylacetamide
CID 61365271
2-hydroxy-N-(2-methyl-3-phenylmethoxypropyl)cyclopentane-1-carboxamide
CID 110015433
N-[3-(2-methoxyphenyl)sulfanyl-2-methylpropyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119776295
N-(2-methyl-3-phenylmethoxypropyl)pyrrolidine-3-carboxamide
CID 119750683
N-[2-(2-methoxyphenoxy)propyl]-2-pyrrolidin-2-ylacetamide
CID 119804831
2-methyl-3-[(2-pyrrolidin-2-ylacetyl)amino]propanoic acid
CID 62669553

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide (CID 119750679) is N-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide is CC(CNC(=O)CC1CCCN1)COCc1ccccc1.
What is the InChIKey of N-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide?
The InChIKey is YQSCRPUNVQWNQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-14(12-21-13-15-6-3-2-4-7-15)11-19-17(20)10-16-8-5-9-18-16/h2-4,6-7,14,16,18H,5,8-13H2,1H3,(H,19,20).
What are the key properties of N-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide?
N-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide has a molecular weight of 290.41 g/mol, XLogP of 2.10, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 119750679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).