2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol

C7H18N2O2 — CID 103387646

IUPAC2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol
SMILESCC(CN)NCCOCCO
InChIInChI=1S/C7H18N2O2/c1-7(6-8)9-2-4-11-5-3-10/h7,9-10H,2-6,8H2,1H3
InChIKeyDNGQZSPIUDGEAH-UHFFFAOYSA-N
MW162.23 g/mol
LogP-1.07
Rot. Bonds7

About 2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol

2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol (PubChem CID 103387646) has the molecular formula C7H18N2O2 and a molecular weight of 162.23 g/mol. Its IUPAC name is 2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol
PubChem CID103387646
Molecular FormulaC7H18N2O2
Molecular Weight162.23 g/mol
Exact Mass162.14
IUPAC Name2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol
SMILESCC(CN)NCCOCCO
InChIInChI=1S/C7H18N2O2/c1-7(6-8)9-2-4-11-5-3-10/h7,9-10H,2-6,8H2,1H3
InChIKeyDNGQZSPIUDGEAH-UHFFFAOYSA-N
XLogP-1.07
TPSA67.51 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 5-1.07
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

2-N-[2-(3-methylbutoxy)ethyl]propane-1,2-diamine
CID 103389691
3-[2-(2-hydroxyethoxy)ethylamino]butanenitrile
CID 62499588
2-[2-(2,6-dimethylheptan-4-ylamino)ethoxy]ethanol
CID 28728057
2-[2-[[(2S)-octan-2-yl]amino]ethoxy]ethanol
CID 29007498
2-[2-[1-(4-aminophenyl)propan-2-ylamino]ethoxy]ethanol
CID 82257190
2-[2-[[(2S,3S)-3-methylpentan-2-yl]amino]ethoxy]ethanol
CID 28728055
N'-hydroxy-2-[2-(2-hydroxyethoxy)ethylamino]propanimidamide
CID 77029466
2-[2-(heptan-4-ylamino)ethoxy]ethanol
CID 28727805
2-[2-[1-(4-methoxyphenyl)propan-2-ylamino]ethoxy]ethanol
CID 43508806
2-(aminomethyl)-N-[3-(2-hydroxyethoxy)propyl]-3-methylbutanamide
CID 106310631
2-[2-(2-hydroxyethoxy)ethylamino]-N-propan-2-ylpropanamide
CID 60654173
2-[2-(2-hydroxyethoxy)ethylamino]-N,N-dimethylpropanamide
CID 60672617

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol?
The IUPAC name of 2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol (CID 103387646) is 2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol?
The canonical SMILES for 2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol is CC(CN)NCCOCCO.
What is the InChIKey of 2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol?
The InChIKey is DNGQZSPIUDGEAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O2/c1-7(6-8)9-2-4-11-5-3-10/h7,9-10H,2-6,8H2,1H3.
What are the key properties of 2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol?
2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol has a molecular weight of 162.23 g/mol, XLogP of -1.07, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-aminopropan-2-ylamino)ethoxy]ethanol is sourced from PubChem (CID 103387646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).