2-methyl-4-(propan-2-ylamino)butan-2-ol

C8H19NO — CID 15889474

IUPAC2-methyl-4-(propan-2-ylamino)butan-2-ol
SMILESCC(C)NCCC(C)(C)O
InChIInChI=1S/C8H19NO/c1-7(2)9-6-5-8(3,4)10/h7,9-10H,5-6H2,1-4H3
InChIKeyFHVUKJWVRBKVRQ-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.15
Rot. Bonds4

About 2-methyl-4-(propan-2-ylamino)butan-2-ol

2-methyl-4-(propan-2-ylamino)butan-2-ol (PubChem CID 15889474) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is 2-methyl-4-(propan-2-ylamino)butan-2-ol.

Molecular Properties

Compound Name2-methyl-4-(propan-2-ylamino)butan-2-ol
PubChem CID15889474
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name2-methyl-4-(propan-2-ylamino)butan-2-ol
SMILESCC(C)NCCC(C)(C)O
InChIInChI=1S/C8H19NO/c1-7(2)9-6-5-8(3,4)10/h7,9-10H,5-6H2,1-4H3
InChIKeyFHVUKJWVRBKVRQ-UHFFFAOYSA-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 2-methyl-4-(propan-2-ylamino)butan-2-ol?
The IUPAC name of 2-methyl-4-(propan-2-ylamino)butan-2-ol (CID 15889474) is 2-methyl-4-(propan-2-ylamino)butan-2-ol.
What is the SMILES notation for 2-methyl-4-(propan-2-ylamino)butan-2-ol?
The canonical SMILES for 2-methyl-4-(propan-2-ylamino)butan-2-ol is CC(C)NCCC(C)(C)O.
What is the InChIKey of 2-methyl-4-(propan-2-ylamino)butan-2-ol?
The InChIKey is FHVUKJWVRBKVRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-7(2)9-6-5-8(3,4)10/h7,9-10H,5-6H2,1-4H3.
What are the key properties of 2-methyl-4-(propan-2-ylamino)butan-2-ol?
2-methyl-4-(propan-2-ylamino)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 2-methyl-4-(propan-2-ylamino)butan-2-ol is sourced from PubChem (CID 15889474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).