(3S,4R)-3-amino-4-methylazetidin-2-ol

C4H10N2O — CID 118102125

IUPAC(3S,4R)-3-amino-4-methylazetidin-2-ol
SMILESC[C@H]1NC(O)[C@H]1N
InChIInChI=1S/C4H10N2O/c1-2-3(5)4(7)6-2/h2-4,6-7H,5H2,1H3/t2-,3+,4?/m1/s1
InChIKeyQHTIZEZZNBCPLT-BCDHYOAOSA-N
MW102.14 g/mol
LogP-1.38
Rot. Bonds

About (3S,4R)-3-amino-4-methylazetidin-2-ol

(3S,4R)-3-amino-4-methylazetidin-2-ol (PubChem CID 118102125) has the molecular formula C4H10N2O and a molecular weight of 102.14 g/mol. Its IUPAC name is (3S,4R)-3-amino-4-methylazetidin-2-ol.

Molecular Properties

Compound Name(3S,4R)-3-amino-4-methylazetidin-2-ol
PubChem CID118102125
Molecular FormulaC4H10N2O
Molecular Weight102.14 g/mol
Exact Mass102.08
IUPAC Name(3S,4R)-3-amino-4-methylazetidin-2-ol
SMILESC[C@H]1NC(O)[C@H]1N
InChIInChI=1S/C4H10N2O/c1-2-3(5)4(7)6-2/h2-4,6-7H,5H2,1H3/t2-,3+,4?/m1/s1
InChIKeyQHTIZEZZNBCPLT-BCDHYOAOSA-N
XLogP-1.38
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.14
LogP ≤ 5-1.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 163883112
4-amino-5-methylpyrrolidine-2-carboxylic acid
CID 55289228
3,4-diamino-2,5,6-trimethylcyclohexan-1-ol
CID 163574132
2,6-dimethylpiperidin-3-amine;dihydrochloride
CID 174859895
6-bromo-2-methylpiperidin-3-amine
CID 176942943
(3S)-5-amino-2-methylpiperidine-3,4-diol
CID 59928049
(1S,2R,4S,5S)-3,6-diaminocyclohexane-1,2,4,5-tetrol
CID 130935032
(2R,5S)-4-amino-2,6-dimethyloxane-3,5-diol
CID 89232142
(2S,3R,4R,5R,6S)-2-(aminomethyl)-6-methylpiperidine-3,4,5-triol
CID 10420740
4,5-dimethylpyrrolidin-2-ol
CID 163490256
2-amino-3,7,9-trimethyl-1,2,4,5,6,8-hexahydropurin-6-ol
CID 129090595

Frequently Asked Questions

What is the IUPAC name of (3S,4R)-3-amino-4-methylazetidin-2-ol?
The IUPAC name of (3S,4R)-3-amino-4-methylazetidin-2-ol (CID 118102125) is (3S,4R)-3-amino-4-methylazetidin-2-ol.
What is the SMILES notation for (3S,4R)-3-amino-4-methylazetidin-2-ol?
The canonical SMILES for (3S,4R)-3-amino-4-methylazetidin-2-ol is C[C@H]1NC(O)[C@H]1N.
What is the InChIKey of (3S,4R)-3-amino-4-methylazetidin-2-ol?
The InChIKey is QHTIZEZZNBCPLT-BCDHYOAOSA-N. The full InChI is InChI=1S/C4H10N2O/c1-2-3(5)4(7)6-2/h2-4,6-7H,5H2,1H3/t2-,3+,4?/m1/s1.
What are the key properties of (3S,4R)-3-amino-4-methylazetidin-2-ol?
(3S,4R)-3-amino-4-methylazetidin-2-ol has a molecular weight of 102.14 g/mol, XLogP of -1.38, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,4R)-3-amino-4-methylazetidin-2-ol is sourced from PubChem (CID 118102125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).