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

C10H23NO — CID 116960105

IUPAC4-methyl-3-(methylamino)-2-propan-2-ylpentan-1-ol
SMILESCNC(C(C)C)C(CO)C(C)C
InChIInChI=1S/C10H23NO/c1-7(2)9(6-12)10(11-5)8(3)4/h7-12H,6H2,1-5H3
InChIKeyWCKUWFYVHNXNCJ-UHFFFAOYSA-N
MW173.30 g/mol
LogP1.49
Rot. Bonds5

About 4-methyl-3-(methylamino)-2-propan-2-ylpentan-1-ol

4-methyl-3-(methylamino)-2-propan-2-ylpentan-1-ol (PubChem CID 116960105) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 4-methyl-3-(methylamino)-2-propan-2-ylpentan-1-ol.

Molecular Properties

Compound Name4-methyl-3-(methylamino)-2-propan-2-ylpentan-1-ol
PubChem CID116960105
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name4-methyl-3-(methylamino)-2-propan-2-ylpentan-1-ol
SMILESCNC(C(C)C)C(CO)C(C)C
InChIInChI=1S/C10H23NO/c1-7(2)9(6-12)10(11-5)8(3)4/h7-12H,6H2,1-5H3
InChIKeyWCKUWFYVHNXNCJ-UHFFFAOYSA-N
XLogP1.49
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-(methylamino)-2-propan-2-ylpentan-1-ol?
The IUPAC name of 4-methyl-3-(methylamino)-2-propan-2-ylpentan-1-ol (CID 116960105) is 4-methyl-3-(methylamino)-2-propan-2-ylpentan-1-ol.
What is the SMILES notation for 4-methyl-3-(methylamino)-2-propan-2-ylpentan-1-ol?
The canonical SMILES for 4-methyl-3-(methylamino)-2-propan-2-ylpentan-1-ol is CNC(C(C)C)C(CO)C(C)C.
What is the InChIKey of 4-methyl-3-(methylamino)-2-propan-2-ylpentan-1-ol?
The InChIKey is WCKUWFYVHNXNCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-7(2)9(6-12)10(11-5)8(3)4/h7-12H,6H2,1-5H3.
What are the key properties of 4-methyl-3-(methylamino)-2-propan-2-ylpentan-1-ol?
4-methyl-3-(methylamino)-2-propan-2-ylpentan-1-ol has a molecular weight of 173.30 g/mol, XLogP of 1.49, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-(methylamino)-2-propan-2-ylpentan-1-ol is sourced from PubChem (CID 116960105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).