3-aminopropan-1-ol

C3H9NO — CID 9086

IUPAC3-aminopropan-1-ol
SMILESNCCCO
InChIInChI=1S/C3H9NO/c4-2-1-3-5/h5H,1-4H2
InChIKeyWUGQZFFCHPXWKQ-UHFFFAOYSA-N
MW75.11 g/mol
LogP-0.67
Rot. Bonds2

About 3-aminopropan-1-ol

3-aminopropan-1-ol (PubChem CID 9086) has the molecular formula C3H9NO and a molecular weight of 75.11 g/mol. Its IUPAC name is 3-aminopropan-1-ol.

Molecular Properties

Compound Name3-aminopropan-1-ol
PubChem CID9086
Molecular FormulaC3H9NO
Molecular Weight75.11 g/mol
Exact Mass75.07
IUPAC Name3-aminopropan-1-ol
SMILESNCCCO
InChIInChI=1S/C3H9NO/c4-2-1-3-5/h5H,1-4H2
InChIKeyWUGQZFFCHPXWKQ-UHFFFAOYSA-N
XLogP-0.67
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50075.11
LogP ≤ 5-0.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Ethanolaminium(1+)
CID 444693
3-Amino-2-methyl-1-propanol
CID 10197625
(2S)-3-amino-2-methylpropan-1-ol
CID 640990
3-Amino-1-propanol hydrochloride
CID 3014826
2-Aminoethyloxidanium
CID 4272803
(2R)-3-amino-2-methylpropan-1-ol
CID 13906733
O,O'-Bis(3-aminopropyl)polyethylene glycol 1'500
CID 16211282
3-Amino-2-fluoropropan-1-ol hydrochloride
CID 146013273
(2s)-Aminopropanol
CID 54097278
3-Hydroxypropan-1-aminium
CID 1551059
Aminopropanol
CID 5256658
Dihydroxypropyl amine
CID 5242570

Frequently Asked Questions

What is the IUPAC name of 3-aminopropan-1-ol?
The IUPAC name of 3-aminopropan-1-ol (CID 9086) is 3-aminopropan-1-ol.
What is the SMILES notation for 3-aminopropan-1-ol?
The canonical SMILES for 3-aminopropan-1-ol is NCCCO.
What is the InChIKey of 3-aminopropan-1-ol?
The InChIKey is WUGQZFFCHPXWKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9NO/c4-2-1-3-5/h5H,1-4H2.
What are the key properties of 3-aminopropan-1-ol?
3-aminopropan-1-ol has a molecular weight of 75.11 g/mol, XLogP of -0.67, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-aminopropan-1-ol is sourced from PubChem (CID 9086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).