4-(methylamino)pyrrolidin-2-ol

C5H12N2O — CID 168891458

IUPAC4-(methylamino)pyrrolidin-2-ol
SMILESCNC1CNC(O)C1
InChIInChI=1S/C5H12N2O/c1-6-4-2-5(8)7-3-4/h4-8H,2-3H2,1H3
InChIKeyVOWXKXGCINUTPY-UHFFFAOYSA-N
MW116.16 g/mol
LogP-1.11
Rot. Bonds1

About 4-(methylamino)pyrrolidin-2-ol

4-(methylamino)pyrrolidin-2-ol (PubChem CID 168891458) has the molecular formula C5H12N2O and a molecular weight of 116.16 g/mol. Its IUPAC name is 4-(methylamino)pyrrolidin-2-ol.

Molecular Properties

Compound Name4-(methylamino)pyrrolidin-2-ol
PubChem CID168891458
Molecular FormulaC5H12N2O
Molecular Weight116.16 g/mol
Exact Mass116.09
IUPAC Name4-(methylamino)pyrrolidin-2-ol
SMILESCNC1CNC(O)C1
InChIInChI=1S/C5H12N2O/c1-6-4-2-5(8)7-3-4/h4-8H,2-3H2,1H3
InChIKeyVOWXKXGCINUTPY-UHFFFAOYSA-N
XLogP-1.11
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 5-1.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-N,5-N-dimethylpiperidine-3,5-diamine
CID 143020328
4-fluoropyrrolidin-2-ol
CID 89311737
4-aminopyrrolidin-2-ol;hydrochloride
CID 174763411
5-(methylamino)cyclohexane-1,3-diol
CID 69462878
[5-(methylamino)piperidin-2-yl]methanol
CID 123321143
7-(methylamino)-3-oxabicyclo[3.3.1]nonan-9-ol
CID 118473848
N-methylazetidin-3-amine;hydrochloride
CID 53313443
3-fluoro-N-methylcyclobutan-1-amine
CID 84715977
N-methyl-6-azabicyclo[3.2.1]octan-3-amine
CID 171036183
(3aR,6aS)-5-(methylamino)-1,2,3,3a,4,5,6,6a-octahydropentalen-2-ol;hydrochloride
CID 154919470
3-(methylamino)cyclopentan-1-ol;hydrochloride
CID 162422237
5-methylpiperazin-2-ol;hydrochloride
CID 174721489

Frequently Asked Questions

What is the IUPAC name of 4-(methylamino)pyrrolidin-2-ol?
The IUPAC name of 4-(methylamino)pyrrolidin-2-ol (CID 168891458) is 4-(methylamino)pyrrolidin-2-ol.
What is the SMILES notation for 4-(methylamino)pyrrolidin-2-ol?
The canonical SMILES for 4-(methylamino)pyrrolidin-2-ol is CNC1CNC(O)C1.
What is the InChIKey of 4-(methylamino)pyrrolidin-2-ol?
The InChIKey is VOWXKXGCINUTPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O/c1-6-4-2-5(8)7-3-4/h4-8H,2-3H2,1H3.
What are the key properties of 4-(methylamino)pyrrolidin-2-ol?
4-(methylamino)pyrrolidin-2-ol has a molecular weight of 116.16 g/mol, XLogP of -1.11, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)pyrrolidin-2-ol is sourced from PubChem (CID 168891458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).