3-[ethoxy(ethyl)amino]propan-1-ol

C7H17NO2 — CID 130124648

IUPAC3-[ethoxy(ethyl)amino]propan-1-ol
SMILESCCON(CC)CCCO
InChIInChI=1S/C7H17NO2/c1-3-8(10-4-2)6-5-7-9/h9H,3-7H2,1-2H3
InChIKeyKJEQRFBGFRGGHS-UHFFFAOYSA-N
MW147.22 g/mol
LogP0.64
Rot. Bonds6

About 3-[ethoxy(ethyl)amino]propan-1-ol

3-[ethoxy(ethyl)amino]propan-1-ol (PubChem CID 130124648) has the molecular formula C7H17NO2 and a molecular weight of 147.22 g/mol. Its IUPAC name is 3-[ethoxy(ethyl)amino]propan-1-ol.

Molecular Properties

Compound Name3-[ethoxy(ethyl)amino]propan-1-ol
PubChem CID130124648
Molecular FormulaC7H17NO2
Molecular Weight147.22 g/mol
Exact Mass147.13
IUPAC Name3-[ethoxy(ethyl)amino]propan-1-ol
SMILESCCON(CC)CCCO
InChIInChI=1S/C7H17NO2/c1-3-8(10-4-2)6-5-7-9/h9H,3-7H2,1-2H3
InChIKeyKJEQRFBGFRGGHS-UHFFFAOYSA-N
XLogP0.64
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-[ethyl(methoxy)amino]propan-1-ol
CID 87086707
N-butyl-N-ethoxypentan-1-amine
CID 174575432
N-butyl-N-ethoxydodecan-1-amine
CID 150955384
2-[dodecoxy(ethyl)amino]ethanol
CID 19017012
N-dodecyl-N-ethoxydodecan-1-amine
CID 152741413
2-[2-(dimethylamino)ethoxy-ethylamino]ethanol
CID 175534139
bis(3-(diethylamino)propan-1-ol);zirconium
CID 158788459
N-ethyl-N-prop-1-en-2-yloxybutan-1-amine
CID 167223941
4-[butyl(4-hydroxybutoxy)amino]oxybutan-1-ol
CID 87183048
3-[tert-butyl(ethyl)amino]propan-1-ol
CID 138079476
3-[ethyl(hexadecyl)amino]propan-1-ol
CID 138077517
3-[3-(diethylamino)propyl-methylamino]propan-1-ol
CID 12721796

Frequently Asked Questions

What is the IUPAC name of 3-[ethoxy(ethyl)amino]propan-1-ol?
The IUPAC name of 3-[ethoxy(ethyl)amino]propan-1-ol (CID 130124648) is 3-[ethoxy(ethyl)amino]propan-1-ol.
What is the SMILES notation for 3-[ethoxy(ethyl)amino]propan-1-ol?
The canonical SMILES for 3-[ethoxy(ethyl)amino]propan-1-ol is CCON(CC)CCCO.
What is the InChIKey of 3-[ethoxy(ethyl)amino]propan-1-ol?
The InChIKey is KJEQRFBGFRGGHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO2/c1-3-8(10-4-2)6-5-7-9/h9H,3-7H2,1-2H3.
What are the key properties of 3-[ethoxy(ethyl)amino]propan-1-ol?
3-[ethoxy(ethyl)amino]propan-1-ol has a molecular weight of 147.22 g/mol, XLogP of 0.64, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[ethoxy(ethyl)amino]propan-1-ol is sourced from PubChem (CID 130124648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).