N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine

C11H24N2 — CID 114515255

IUPACN-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine
SMILESCCCNCCC1CCN(C)CC1
InChIInChI=1S/C11H24N2/c1-3-7-12-8-4-11-5-9-13(2)10-6-11/h11-12H,3-10H2,1-2H3
InChIKeyGGYPRMSIUQXFEN-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.72
Rot. Bonds5

About N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine

N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine (PubChem CID 114515255) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine
PubChem CID114515255
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine
SMILESCCCNCCC1CCN(C)CC1
InChIInChI=1S/C11H24N2/c1-3-7-12-8-4-11-5-9-13(2)10-6-11/h11-12H,3-10H2,1-2H3
InChIKeyGGYPRMSIUQXFEN-UHFFFAOYSA-N
XLogP1.72
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(1-methylpiperidin-4-yl)ethylamino]ethanethiol
CID 115224308
[2-(1-methylpiperidin-4-yl)ethylamino]methanol
CID 115229407
N-ethyl-N'-[2-(1-methylpyrrolidin-3-yl)ethyl]ethane-1,2-diamine
CID 115206064
2-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine
CID 115876275
2-(1-methylpiperidin-4-yl)-N-(2-pyrazol-1-ylethyl)ethanamine
CID 114515462
2-(1-methylpiperidin-4-yl)-N-(2-piperazin-1-ylethyl)ethanamine
CID 115230410
2-(1-methylpiperidin-4-yl)-N-(2-pyrrolidin-2-ylethyl)ethanamine
CID 115210457
N-[2-(1-methylpiperidin-4-yl)ethyl]pent-4-yn-1-amine
CID 114515637
N-[2-(1-methylpiperidin-4-yl)ethyl]-1-(propylamino)propane-2-sulfonamide
CID 106082678
N-[(4-ethylphenyl)methyl]-2-(1-methylpiperidin-4-yl)ethanamine
CID 115615095
N-[2-(1-methylpiperidin-4-yl)ethyl]-3-piperazin-1-ylpropan-1-amine
CID 115230617
N-methyl-2-[2-(1-methylpiperidin-4-yl)ethylamino]acetamide
CID 114515397

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine?
The IUPAC name of N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine (CID 114515255) is N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine.
What is the SMILES notation for N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine?
The canonical SMILES for N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine is CCCNCCC1CCN(C)CC1.
What is the InChIKey of N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine?
The InChIKey is GGYPRMSIUQXFEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-3-7-12-8-4-11-5-9-13(2)10-6-11/h11-12H,3-10H2,1-2H3.
What are the key properties of N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine?
N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine has a molecular weight of 184.33 g/mol, XLogP of 1.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine is sourced from PubChem (CID 114515255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).