2-methyl-3-(methylamino)propan-1-ol

C5H13NO — CID 23264324

IUPAC2-methyl-3-(methylamino)propan-1-ol
SMILESCNCC(C)CO
InChIInChI=1S/C5H13NO/c1-5(4-7)3-6-2/h5-7H,3-4H2,1-2H3
InChIKeyQIMXXSHKYGRQBW-UHFFFAOYSA-N
MW103.17 g/mol
LogP-0.17
Rot. Bonds3

About 2-methyl-3-(methylamino)propan-1-ol

2-methyl-3-(methylamino)propan-1-ol (PubChem CID 23264324) has the molecular formula C5H13NO and a molecular weight of 103.17 g/mol. Its IUPAC name is 2-methyl-3-(methylamino)propan-1-ol.

Molecular Properties

Compound Name2-methyl-3-(methylamino)propan-1-ol
PubChem CID23264324
Molecular FormulaC5H13NO
Molecular Weight103.17 g/mol
Exact Mass103.10
IUPAC Name2-methyl-3-(methylamino)propan-1-ol
SMILESCNCC(C)CO
InChIInChI=1S/C5H13NO/c1-5(4-7)3-6-2/h5-7H,3-4H2,1-2H3
InChIKeyQIMXXSHKYGRQBW-UHFFFAOYSA-N
XLogP-0.17
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.17
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-3-(propan-2-ylamino)propan-1-ol
CID 20806708
(2S,4S)-4-methyl-5-(methylamino)pentan-2-ol
CID 155217722
3-(1-hydroxyethylamino)-2-methylpropan-1-ol
CID 57165615
3-[[2-hydroxy-3-[(3-hydroxy-2-methylpropyl)amino]propyl]amino]-2-methylpropan-1-ol
CID 88540594
(2S)-N,2,4-trimethylpentan-1-amine
CID 90327710
ethane;2-methylpropane-1,3-diol
CID 87127502
4-methyl-5-(methylamino)pentan-2-one
CID 20632141
(2S)-3-[(3-hydroxy-2-methylpropyl)amino]propane-1,2-diol
CID 65036137
N,N',2-trimethylbutane-1,4-diamine
CID 118562812
ethane;N,2,4-trimethylpentan-1-amine
CID 142844862
2-methyl-3-(4-methylpentan-2-ylamino)propan-1-ol
CID 65032247
(2R)-3-(2-aminoethylamino)-2-methylpropan-1-ol
CID 58592003

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(methylamino)propan-1-ol?
The IUPAC name of 2-methyl-3-(methylamino)propan-1-ol (CID 23264324) is 2-methyl-3-(methylamino)propan-1-ol.
What is the SMILES notation for 2-methyl-3-(methylamino)propan-1-ol?
The canonical SMILES for 2-methyl-3-(methylamino)propan-1-ol is CNCC(C)CO.
What is the InChIKey of 2-methyl-3-(methylamino)propan-1-ol?
The InChIKey is QIMXXSHKYGRQBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO/c1-5(4-7)3-6-2/h5-7H,3-4H2,1-2H3.
What are the key properties of 2-methyl-3-(methylamino)propan-1-ol?
2-methyl-3-(methylamino)propan-1-ol has a molecular weight of 103.17 g/mol, XLogP of -0.17, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(methylamino)propan-1-ol is sourced from PubChem (CID 23264324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).