N-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide

C17H26N2O2 — CID 24843752

IUPACN-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide
SMILESCC(COc1ccccc1)N(C)C(=O)CCN1CCCC1
InChIInChI=1S/C17H26N2O2/c1-15(14-21-16-8-4-3-5-9-16)18(2)17(20)10-13-19-11-6-7-12-19/h3-5,8-9,15H,6-7,10-14H2,1-2H3
InChIKeyOIANBCXNGVNOJD-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.40
Rot. Bonds7

About N-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide

N-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide (PubChem CID 24843752) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide.

Molecular Properties

Compound NameN-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide
PubChem CID24843752
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide
SMILESCC(COc1ccccc1)N(C)C(=O)CCN1CCCC1
InChIInChI=1S/C17H26N2O2/c1-15(14-21-16-8-4-3-5-9-16)18(2)17(20)10-13-19-11-6-7-12-19/h3-5,8-9,15H,6-7,10-14H2,1-2H3
InChIKeyOIANBCXNGVNOJD-UHFFFAOYSA-N
XLogP2.40
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(dimethylamino)-N-methyl-N-(1-phenoxypropan-2-yl)propanamide;hydrochloride
CID 3064445
N-methyl-N-phenyl-3-piperidin-1-ylpropanamide
CID 110688340
N-(1-aminopropan-2-yl)-N-methyl-4-phenoxybutanamide
CID 119581308
1-(2-ethoxyphenyl)-3-piperidin-1-ylpropan-1-one
CID 58514237
N-methyl-2-[methyl(2-pyrrolidin-1-ylethyl)amino]-N-(2-phenoxyethyl)acetamide;hydrochloride
CID 20846546
hydron;1-[4-(2-methylpropoxy)phenyl]-3-piperidin-1-ylpropan-1-one;chloride
CID 644984
2-[methyl(3-phenoxypropanoyl)amino]propanoic acid
CID 62626003
3-phenoxy-N-(2-pyrrolidin-1-ylethoxy)propanamide
CID 110643041
N,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide
CID 78792872
1-(4-methoxyphenyl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propan-1-one
CID 63207477
1-methyl-1-(1-phenoxypropan-2-yl)guanidine
CID 139746217
1-(4-methylphenyl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propan-1-one
CID 63207733

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide?
The IUPAC name of N-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide (CID 24843752) is N-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide.
What is the SMILES notation for N-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide?
The canonical SMILES for N-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide is CC(COc1ccccc1)N(C)C(=O)CCN1CCCC1.
What is the InChIKey of N-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide?
The InChIKey is OIANBCXNGVNOJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-15(14-21-16-8-4-3-5-9-16)18(2)17(20)10-13-19-11-6-7-12-19/h3-5,8-9,15H,6-7,10-14H2,1-2H3.
What are the key properties of N-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide?
N-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide has a molecular weight of 290.41 g/mol, XLogP of 2.40, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-phenoxypropan-2-yl)-3-pyrrolidin-1-ylpropanamide is sourced from PubChem (CID 24843752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).