N-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide

C18H28N2O3 — CID 51362417

IUPACN-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide
SMILESCOc1ccccc1CN1CCC(C(=O)NC(C)(C)CO)CC1
InChIInChI=1S/C18H28N2O3/c1-18(2,13-21)19-17(22)14-8-10-20(11-9-14)12-15-6-4-5-7-16(15)23-3/h4-7,14,21H,8-13H2,1-3H3,(H,19,22)
InChIKeyLZGKWELTGOTWGG-UHFFFAOYSA-N
MW320.43 g/mol
LogP1.79
Rot. Bonds6

About N-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide

N-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide (PubChem CID 51362417) has the molecular formula C18H28N2O3 and a molecular weight of 320.43 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide
PubChem CID51362417
Molecular FormulaC18H28N2O3
Molecular Weight320.43 g/mol
Exact Mass320.21
IUPAC NameN-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide
SMILESCOc1ccccc1CN1CCC(C(=O)NC(C)(C)CO)CC1
InChIInChI=1S/C18H28N2O3/c1-18(2,13-21)19-17(22)14-8-10-20(11-9-14)12-15-6-4-5-7-16(15)23-3/h4-7,14,21H,8-13H2,1-3H3,(H,19,22)
InChIKeyLZGKWELTGOTWGG-UHFFFAOYSA-N
XLogP1.79
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.43
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-hydroxy-2-methylpropan-2-yl)-1-(naphthalen-1-ylmethyl)piperidine-4-carboxamide
CID 51362423
N-tert-butyl-1-[(2-hydroxy-3-methoxyphenyl)methyl]piperidine-4-carboxamide
CID 795625
4-chloro-1-[(2-methoxyphenyl)methyl]piperidine
CID 63389508
1-[(2-methoxyphenyl)methyl]-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide
CID 1096579
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide
CID 30137323
1-[(2-methoxyphenyl)methyl]-N-(oxan-3-yl)piperidine-4-carboxamide
CID 46963470
N-(2-methoxyphenyl)-1-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxamide
CID 37179444
methyl 1-[(2-ethoxyphenyl)methyl]piperidine-4-carboxylate
CID 60670101
1-[(2-methoxyphenyl)methyl]piperidin-4-amine
CID 70277411
cyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone
CID 110398973
(4-ethylpiperazin-1-yl)-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methanone;oxalic acid
CID 163328426
N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]-pyridin-2-ylmethyl]cyclopropanecarboxamide
CID 110226611

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide?
The IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide (CID 51362417) is N-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for N-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for N-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide is COc1ccccc1CN1CCC(C(=O)NC(C)(C)CO)CC1.
What is the InChIKey of N-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide?
The InChIKey is LZGKWELTGOTWGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O3/c1-18(2,13-21)19-17(22)14-8-10-20(11-9-14)12-15-6-4-5-7-16(15)23-3/h4-7,14,21H,8-13H2,1-3H3,(H,19,22).
What are the key properties of N-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide?
N-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide has a molecular weight of 320.43 g/mol, XLogP of 1.79, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-methylpropan-2-yl)-1-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 51362417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).