N-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide

C14H29N3O2 — CID 114499096

IUPACN-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide
SMILESCNC1CCN(C(C)C(=O)NCCCOC)CC1C
InChIInChI=1S/C14H29N3O2/c1-11-10-17(8-6-13(11)15-3)12(2)14(18)16-7-5-9-19-4/h11-13,15H,5-10H2,1-4H3,(H,16,18)
InChIKeyHAGXEGPCLZUXLU-UHFFFAOYSA-N
MW271.40 g/mol
LogP0.46
Rot. Bonds7

About N-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide

N-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide (PubChem CID 114499096) has the molecular formula C14H29N3O2 and a molecular weight of 271.40 g/mol. Its IUPAC name is N-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide
PubChem CID114499096
Molecular FormulaC14H29N3O2
Molecular Weight271.40 g/mol
Exact Mass271.23
IUPAC NameN-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide
SMILESCNC1CCN(C(C)C(=O)NCCCOC)CC1C
InChIInChI=1S/C14H29N3O2/c1-11-10-17(8-6-13(11)15-3)12(2)14(18)16-7-5-9-19-4/h11-13,15H,5-10H2,1-4H3,(H,16,18)
InChIKeyHAGXEGPCLZUXLU-UHFFFAOYSA-N
XLogP0.46
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-methoxypropyl)-2-[3-methyl-4-(propylamino)piperidin-1-yl]propanamide
CID 114499445
2-[3-methyl-4-(methylamino)piperidin-1-yl]-N-(2-methylpropyl)propanamide
CID 114499044
2-(3-amino-4-methylpyrrolidin-1-yl)-N-(3-methoxypropyl)propanamide
CID 103577229
2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(3-methoxypropyl)propanamide
CID 63847171
N,N-diethyl-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide
CID 114499097
2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide
CID 115302045
N,N-dimethyl-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide
CID 114499126
1-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]pyrrolidine-3-carboxylic acid
CID 55150446
N-(3-methoxypropyl)-2-[4-[2-(methylamino)acetyl]piperazin-1-yl]propanamide
CID 120704343
2-[3-ethyl-4-(propylamino)piperidin-1-yl]-N-(2-methoxyethyl)propanamide
CID 114507664
(3S,4S)-1-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]-4-methylpyrrolidine-3-carboxylic acid
CID 114086295
2-[4-[hydroxy(phenyl)methyl]piperidin-1-yl]-N-(3-methoxypropyl)propanamide
CID 110898270

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide?
The IUPAC name of N-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide (CID 114499096) is N-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide.
What is the SMILES notation for N-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide?
The canonical SMILES for N-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide is CNC1CCN(C(C)C(=O)NCCCOC)CC1C.
What is the InChIKey of N-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide?
The InChIKey is HAGXEGPCLZUXLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2/c1-11-10-17(8-6-13(11)15-3)12(2)14(18)16-7-5-9-19-4/h11-13,15H,5-10H2,1-4H3,(H,16,18).
What are the key properties of N-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide?
N-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide has a molecular weight of 271.40 g/mol, XLogP of 0.46, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide is sourced from PubChem (CID 114499096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).