(2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide

C19H30N2O2 — CID 97156551

IUPAC(2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide
SMILESCc1cccc([C@H](C(=O)N(C)CC2(CO)CCCC2)N(C)C)c1
InChIInChI=1S/C19H30N2O2/c1-15-8-7-9-16(12-15)17(20(2)3)18(23)21(4)13-19(14-22)10-5-6-11-19/h7-9,12,17,22H,5-6,10-11,13-14H2,1-4H3/t17-/m1/s1
InChIKeyOKVXUHNWPXOPAV-QGZVFWFLSA-N
MW318.46 g/mol
LogP2.61
Rot. Bonds6

About (2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide

(2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide (PubChem CID 97156551) has the molecular formula C19H30N2O2 and a molecular weight of 318.46 g/mol. Its IUPAC name is (2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name(2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide
PubChem CID97156551
Molecular FormulaC19H30N2O2
Molecular Weight318.46 g/mol
Exact Mass318.23
IUPAC Name(2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide
SMILESCc1cccc([C@H](C(=O)N(C)CC2(CO)CCCC2)N(C)C)c1
InChIInChI=1S/C19H30N2O2/c1-15-8-7-9-16(12-15)17(20(2)3)18(23)21(4)13-19(14-22)10-5-6-11-19/h7-9,12,17,22H,5-6,10-11,13-14H2,1-4H3/t17-/m1/s1
InChIKeyOKVXUHNWPXOPAV-QGZVFWFLSA-N
XLogP2.61
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(dimethylamino)-2-(3-fluorophenyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]-N-methylacetamide
CID 95122507
(2R)-2-(dimethylamino)-N-[1-(hydroxymethyl)cyclopentyl]-2-(3-methylphenyl)acetamide
CID 97154573
(2S)-2-(dimethylamino)-N-[(1-hydroxycyclohexyl)methyl]-2-(3-methylphenyl)acetamide
CID 97203958
3-(2-chloro-5-methylphenyl)-1-[[1-(hydroxymethyl)cyclopentyl]methyl]-1-methylurea
CID 72928250
2-(dimethylamino)-N-methyl-2-(3-methylphenyl)-N-[2-(oxan-4-yl)ethyl]acetamide
CID 72885539
N-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-2-(dimethylamino)-N-methyl-2-(3-methylphenyl)acetamide
CID 50960712
(2S)-2-(dimethylamino)-N-[(1-ethylimidazol-2-yl)methyl]-N-methyl-2-(3-methylphenyl)acetamide
CID 97205674
(2S)-2-(dimethylamino)-2-(3-methylphenyl)-1-[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]ethanone
CID 97153883
N-[2-[[2-(dimethylamino)-2-(3-methylphenyl)acetyl]amino]ethyl]-2-methylpropanamide
CID 72849089
(2S)-2-(dimethylamino)-2-(3-methylphenyl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone
CID 97125402
3-(3-chloro-2-fluorophenyl)-1-[[1-(hydroxymethyl)cyclopentyl]methyl]-1-methylurea
CID 72915964
N-[[1-(aminomethyl)cyclopropyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide
CID 115267710

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide?
The IUPAC name of (2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide (CID 97156551) is (2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide.
What is the SMILES notation for (2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide?
The canonical SMILES for (2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide is Cc1cccc([C@H](C(=O)N(C)CC2(CO)CCCC2)N(C)C)c1.
What is the InChIKey of (2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide?
The InChIKey is OKVXUHNWPXOPAV-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H30N2O2/c1-15-8-7-9-16(12-15)17(20(2)3)18(23)21(4)13-19(14-22)10-5-6-11-19/h7-9,12,17,22H,5-6,10-11,13-14H2,1-4H3/t17-/m1/s1.
What are the key properties of (2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide?
(2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide has a molecular weight of 318.46 g/mol, XLogP of 2.61, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-N-methyl-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 97156551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).