(3R)-2-methyl-3-(propylamino)butan-2-ol

C8H19NO — CID 135276625

IUPAC(3R)-2-methyl-3-(propylamino)butan-2-ol
SMILESCCCN[C@H](C)C(C)(C)O
InChIInChI=1S/C8H19NO/c1-5-6-9-7(2)8(3,4)10/h7,9-10H,5-6H2,1-4H3/t7-/m1/s1
InChIKeyLXLYEVYADNVFCN-SSDOTTSWSA-N
MW145.25 g/mol
LogP1.15
Rot. Bonds4

About (3R)-2-methyl-3-(propylamino)butan-2-ol

(3R)-2-methyl-3-(propylamino)butan-2-ol (PubChem CID 135276625) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is (3R)-2-methyl-3-(propylamino)butan-2-ol.

Molecular Properties

Compound Name(3R)-2-methyl-3-(propylamino)butan-2-ol
PubChem CID135276625
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name(3R)-2-methyl-3-(propylamino)butan-2-ol
SMILESCCCN[C@H](C)C(C)(C)O
InChIInChI=1S/C8H19NO/c1-5-6-9-7(2)8(3,4)10/h7,9-10H,5-6H2,1-4H3/t7-/m1/s1
InChIKeyLXLYEVYADNVFCN-SSDOTTSWSA-N
XLogP1.15
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-2-methyl-3-(propylamino)butan-2-ol?
The IUPAC name of (3R)-2-methyl-3-(propylamino)butan-2-ol (CID 135276625) is (3R)-2-methyl-3-(propylamino)butan-2-ol.
What is the SMILES notation for (3R)-2-methyl-3-(propylamino)butan-2-ol?
The canonical SMILES for (3R)-2-methyl-3-(propylamino)butan-2-ol is CCCN[C@H](C)C(C)(C)O.
What is the InChIKey of (3R)-2-methyl-3-(propylamino)butan-2-ol?
The InChIKey is LXLYEVYADNVFCN-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H19NO/c1-5-6-9-7(2)8(3,4)10/h7,9-10H,5-6H2,1-4H3/t7-/m1/s1.
What are the key properties of (3R)-2-methyl-3-(propylamino)butan-2-ol?
(3R)-2-methyl-3-(propylamino)butan-2-ol has a molecular weight of 145.25 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-2-methyl-3-(propylamino)butan-2-ol is sourced from PubChem (CID 135276625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).