N,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine

C13H28N2O — CID 63905483

IUPACN,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine
SMILESCC(C)CN(C)CCCOC1CCNCC1
InChIInChI=1S/C13H28N2O/c1-12(2)11-15(3)9-4-10-16-13-5-7-14-8-6-13/h12-14H,4-11H2,1-3H3
InChIKeyGUNHEMLLALEBME-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.73
Rot. Bonds7

About N,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine

N,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine (PubChem CID 63905483) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is N,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine.

Molecular Properties

Compound NameN,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine
PubChem CID63905483
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC NameN,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine
SMILESCC(C)CN(C)CCCOC1CCNCC1
InChIInChI=1S/C13H28N2O/c1-12(2)11-15(3)9-4-10-16-13-5-7-14-8-6-13/h12-14H,4-11H2,1-3H3
InChIKeyGUNHEMLLALEBME-UHFFFAOYSA-N
XLogP1.73
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.73
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-ethoxyethyl)-N-methyl-3-piperidin-4-yloxypropan-1-amine
CID 81056642
4-(4-methylpentoxy)azepane
CID 63904463
N-methyl-N-[(4-methylphenyl)methyl]-3-piperidin-4-yloxypropan-1-amine
CID 63903014
N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine
CID 63903035
N-[(2-fluorophenyl)methyl]-N-methyl-3-piperidin-4-yloxypropan-1-amine
CID 63902834
4-pentoxypiperidine
CID 43167830
(3R)-3-(4-methylpentoxy)pyrrolidine
CID 115460364
2-ethoxy-N-methyl-N-(2-piperidin-4-yloxyethyl)ethanamine
CID 81055995
N-(3-but-2-ynoxypropyl)-N,2-dimethylpropan-1-amine;ethane
CID 142616069
N,1-dimethyl-N-(2-piperidin-4-yloxyethyl)piperidin-4-amine
CID 55251859
1-cyclopropyl-N-(2-methoxyethyl)-N-(2-piperidin-4-yloxyethyl)ethanamine
CID 55252268
3-methyl-N-(3-piperidin-4-yloxypropyl)-2-propan-2-ylbutan-1-amine
CID 102913624

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine?
The IUPAC name of N,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine (CID 63905483) is N,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine.
What is the SMILES notation for N,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine?
The canonical SMILES for N,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine is CC(C)CN(C)CCCOC1CCNCC1.
What is the InChIKey of N,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine?
The InChIKey is GUNHEMLLALEBME-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-12(2)11-15(3)9-4-10-16-13-5-7-14-8-6-13/h12-14H,4-11H2,1-3H3.
What are the key properties of N,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine?
N,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine has a molecular weight of 228.38 g/mol, XLogP of 1.73, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine is sourced from PubChem (CID 63905483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).