1-(cyclopropylamino)-3-methoxypropan-2-ol

C7H15NO2 — CID 21034992

IUPAC1-(cyclopropylamino)-3-methoxypropan-2-ol
SMILESCOCC(O)CNC1CC1
InChIInChI=1S/C7H15NO2/c1-10-5-7(9)4-8-6-2-3-6/h6-9H,2-5H2,1H3
InChIKeyFTDMMJZYBUCRBV-UHFFFAOYSA-N
MW145.20 g/mol
LogP-0.25
Rot. Bonds5

About 1-(cyclopropylamino)-3-methoxypropan-2-ol

1-(cyclopropylamino)-3-methoxypropan-2-ol (PubChem CID 21034992) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is 1-(cyclopropylamino)-3-methoxypropan-2-ol.

Molecular Properties

Compound Name1-(cyclopropylamino)-3-methoxypropan-2-ol
PubChem CID21034992
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name1-(cyclopropylamino)-3-methoxypropan-2-ol
SMILESCOCC(O)CNC1CC1
InChIInChI=1S/C7H15NO2/c1-10-5-7(9)4-8-6-2-3-6/h6-9H,2-5H2,1H3
InChIKeyFTDMMJZYBUCRBV-UHFFFAOYSA-N
XLogP-0.25
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-3-methoxypropan-2-ol?
The IUPAC name of 1-(cyclopropylamino)-3-methoxypropan-2-ol (CID 21034992) is 1-(cyclopropylamino)-3-methoxypropan-2-ol.
What is the SMILES notation for 1-(cyclopropylamino)-3-methoxypropan-2-ol?
The canonical SMILES for 1-(cyclopropylamino)-3-methoxypropan-2-ol is COCC(O)CNC1CC1.
What is the InChIKey of 1-(cyclopropylamino)-3-methoxypropan-2-ol?
The InChIKey is FTDMMJZYBUCRBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-10-5-7(9)4-8-6-2-3-6/h6-9H,2-5H2,1H3.
What are the key properties of 1-(cyclopropylamino)-3-methoxypropan-2-ol?
1-(cyclopropylamino)-3-methoxypropan-2-ol has a molecular weight of 145.20 g/mol, XLogP of -0.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-3-methoxypropan-2-ol is sourced from PubChem (CID 21034992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).