2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol

C10H23N3O — CID 167265274

IUPAC2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol
SMILESCN1CCC(NCCNCCO)CC1
InChIInChI=1S/C10H23N3O/c1-13-7-2-10(3-8-13)12-5-4-11-6-9-14/h10-12,14H,2-9H2,1H3
InChIKeyGWFGZTNHYILYOM-UHFFFAOYSA-N
MW201.31 g/mol
LogP-0.75
Rot. Bonds6

About 2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol

2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol (PubChem CID 167265274) has the molecular formula C10H23N3O and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol.

Molecular Properties

Compound Name2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol
PubChem CID167265274
Molecular FormulaC10H23N3O
Molecular Weight201.31 g/mol
Exact Mass201.18
IUPAC Name2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol
SMILESCN1CCC(NCCNCCO)CC1
InChIInChI=1S/C10H23N3O/c1-13-7-2-10(3-8-13)12-5-4-11-6-9-14/h10-12,14H,2-9H2,1H3
InChIKeyGWFGZTNHYILYOM-UHFFFAOYSA-N
XLogP-0.75
TPSA47.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 5-0.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-[(1-methylpiperidin-4-yl)amino]hexan-1-ol
CID 115906765
N,N'-bis(1-methylpiperidin-4-yl)hexane-1,6-diamine
CID 4712087
3-[(1-methylpiperidin-4-yl)amino]propanamide
CID 43373494
N-(3,3-dimethylbutyl)-1-methylpiperidin-4-amine
CID 60693743
1-N-[2-[(1-methylpiperidin-4-yl)amino]ethyl]cyclobutane-1,3-diamine
CID 170106320
N-(2-cyclobutylethyl)-1-methylpiperidin-4-amine
CID 115893453
1-methyl-N-(3,3,3-trifluoropropyl)piperidin-4-amine
CID 60696502
1-(2-hydroxyethyl)-3-(1-methylpiperidin-4-yl)urea
CID 117234476
5-[(1-methylpiperidin-4-yl)amino]pentan-2-ol
CID 107270322
2-[2-[(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)amino]ethylamino]ethanol
CID 118045347
1,1-dimethyl-3-[2-[(1-methylpiperidin-4-yl)amino]ethyl]urea
CID 83116217
1-methyl-N-(4-methylpentyl)piperidin-4-amine
CID 61043783

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol?
The IUPAC name of 2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol (CID 167265274) is 2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol.
What is the SMILES notation for 2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol?
The canonical SMILES for 2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol is CN1CCC(NCCNCCO)CC1.
What is the InChIKey of 2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol?
The InChIKey is GWFGZTNHYILYOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O/c1-13-7-2-10(3-8-13)12-5-4-11-6-9-14/h10-12,14H,2-9H2,1H3.
What are the key properties of 2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol?
2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol has a molecular weight of 201.31 g/mol, XLogP of -0.75, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(1-methylpiperidin-4-yl)amino]ethylamino]ethanol is sourced from PubChem (CID 167265274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).