N-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide

C15H30N2O2 — CID 112604980

IUPACN-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC1CCN(CCCNC(=O)COC(C)(C)C)CC1
InChIInChI=1S/C15H30N2O2/c1-13-6-10-17(11-7-13)9-5-8-16-14(18)12-19-15(2,3)4/h13H,5-12H2,1-4H3,(H,16,18)
InChIKeyMBACBKBYNREXTD-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.04
Rot. Bonds6

About N-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide

N-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide (PubChem CID 112604980) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is N-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide.

Molecular Properties

Compound NameN-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
PubChem CID112604980
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC NameN-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC1CCN(CCCNC(=O)COC(C)(C)C)CC1
InChIInChI=1S/C15H30N2O2/c1-13-6-10-17(11-7-13)9-5-8-16-14(18)12-19-15(2,3)4/h13H,5-12H2,1-4H3,(H,16,18)
InChIKeyMBACBKBYNREXTD-UHFFFAOYSA-N
XLogP2.04
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605264
N-[3-(4-methylpiperazin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604362
2-bromo-N-[3-(4-methylpiperidin-1-yl)propyl]acetamide
CID 63679463
tert-butyl N-[3-(4-methylazepan-1-yl)propyl]carbamate
CID 143014602
2-amino-2-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]propanamide
CID 61265469
N-methyl-2-[5-[4-[2-[[2-[4-(4-methylpiperidin-1-yl)butoxy]acetyl]amino]ethyl]piperidin-1-yl]pentoxy]acetamide
CID 147513426
N-butyl-3-(4-methylpiperidin-1-yl)propanamide
CID 109012179
3,3-dimethyl-5-[2-(4-methylpiperidin-1-yl)ethylamino]-5-oxopentanoic acid
CID 62934088
2-[(2-methylpropan-2-yl)oxy]-N-(3-sulfanylpropyl)acetamide
CID 155051712
(2R)-2-amino-N-[3-(4-methylpiperidin-1-yl)propyl]butanamide
CID 79023285
2-[1-(aminomethyl)cyclobutyl]-N-[3-(4-methylpiperidin-1-yl)propyl]acetamide
CID 81172973
4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine
CID 59691701

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The IUPAC name of N-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide (CID 112604980) is N-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide.
What is the SMILES notation for N-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The canonical SMILES for N-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide is CC1CCN(CCCNC(=O)COC(C)(C)C)CC1.
What is the InChIKey of N-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The InChIKey is MBACBKBYNREXTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-13-6-10-17(11-7-13)9-5-8-16-14(18)12-19-15(2,3)4/h13H,5-12H2,1-4H3,(H,16,18).
What are the key properties of N-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
N-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide has a molecular weight of 270.42 g/mol, XLogP of 2.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-methylpropan-2-yl)oxy]acetamide is sourced from PubChem (CID 112604980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).