N-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide

C24H32N2O2 — CID 94013550

IUPACN-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide
SMILESCc1ccc(OC[C@@H](C)NC(=O)C2CCN(Cc3ccccc3C)CC2)cc1
InChIInChI=1S/C24H32N2O2/c1-18-8-10-23(11-9-18)28-17-20(3)25-24(27)21-12-14-26(15-13-21)16-22-7-5-4-6-19(22)2/h4-11,20-21H,12-17H2,1-3H3,(H,25,27)/t20-/m1/s1
InChIKeyYTMTYEVXBQAQIA-HXUWFJFHSA-N
MW380.53 g/mol
LogP4.10
Rot. Bonds7

About N-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide

N-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide (PubChem CID 94013550) has the molecular formula C24H32N2O2 and a molecular weight of 380.53 g/mol. Its IUPAC name is N-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide
PubChem CID94013550
Molecular FormulaC24H32N2O2
Molecular Weight380.53 g/mol
Exact Mass380.25
IUPAC NameN-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide
SMILESCc1ccc(OC[C@@H](C)NC(=O)C2CCN(Cc3ccccc3C)CC2)cc1
InChIInChI=1S/C24H32N2O2/c1-18-8-10-23(11-9-18)28-17-20(3)25-24(27)21-12-14-26(15-13-21)16-22-7-5-4-6-19(22)2/h4-11,20-21H,12-17H2,1-3H3,(H,25,27)/t20-/m1/s1
InChIKeyYTMTYEVXBQAQIA-HXUWFJFHSA-N
XLogP4.10
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.53
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(4-chlorophenyl)methyl]-N-[(2S)-1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide
CID 94013561
1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide
CID 132649936
1-[(2-fluorophenyl)methyl]-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]piperidine-4-carboxamide
CID 94013499
1-benzyl-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]piperidine-4-carboxamide
CID 94013477
N-[1-(4-methoxyphenoxy)propan-2-yl]-1-[[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-4-carboxamide
CID 43926786
1-[(4-chloro-2-fluorophenyl)methyl]-N-(1-phenoxypropan-2-yl)piperidine-4-carboxamide
CID 133189759
1-[[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide
CID 43927514
1-[(2-chlorophenyl)methyl]-N-[(2S)-1-methoxypropan-2-yl]piperidine-4-carboxamide
CID 28630305
N-[1-(2-methylphenoxy)propan-2-yl]-1-(4-methylphenyl)piperidine-4-carboxamide
CID 132654892
N-butan-2-yl-1-[(2-hydroxyphenyl)methyl]piperidine-4-carboxamide
CID 46949906
N-[(2R)-butan-2-yl]-1-[(2-hydroxyphenyl)methyl]piperidine-4-carboxamide
CID 795617
1-[(2-methylphenyl)methyl]piperidine-4-carbohydrazide
CID 54793639

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide?
The IUPAC name of N-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide (CID 94013550) is N-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for N-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide is Cc1ccc(OC[C@@H](C)NC(=O)C2CCN(Cc3ccccc3C)CC2)cc1.
What is the InChIKey of N-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide?
The InChIKey is YTMTYEVXBQAQIA-HXUWFJFHSA-N. The full InChI is InChI=1S/C24H32N2O2/c1-18-8-10-23(11-9-18)28-17-20(3)25-24(27)21-12-14-26(15-13-21)16-22-7-5-4-6-19(22)2/h4-11,20-21H,12-17H2,1-3H3,(H,25,27)/t20-/m1/s1.
What are the key properties of N-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide?
N-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide has a molecular weight of 380.53 g/mol, XLogP of 4.10, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 94013550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).