1-(2,2-dimethylpropylamino)propan-2-ol

C8H19NO — CID 21304828

IUPAC1-(2,2-dimethylpropylamino)propan-2-ol
SMILESCC(O)CNCC(C)(C)C
InChIInChI=1S/C8H19NO/c1-7(10)5-9-6-8(2,3)4/h7,9-10H,5-6H2,1-4H3
InChIKeyQDLVIRCXZMYKKB-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.00
Rot. Bonds3

About 1-(2,2-dimethylpropylamino)propan-2-ol

1-(2,2-dimethylpropylamino)propan-2-ol (PubChem CID 21304828) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is 1-(2,2-dimethylpropylamino)propan-2-ol.

Molecular Properties

Compound Name1-(2,2-dimethylpropylamino)propan-2-ol
PubChem CID21304828
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name1-(2,2-dimethylpropylamino)propan-2-ol
SMILESCC(O)CNCC(C)(C)C
InChIInChI=1S/C8H19NO/c1-7(10)5-9-6-8(2,3)4/h7,9-10H,5-6H2,1-4H3
InChIKeyQDLVIRCXZMYKKB-UHFFFAOYSA-N
XLogP1.00
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-1-[(2-methoxy-2-methylpropyl)amino]propan-2-ol
CID 106932513
1-(2,2-dimethylpropylamino)-4-methylpentan-2-ol;hydrochloride
CID 115607724
1-[[(2R)-2-hydroxypropyl]amino]-2,4-dimethylpentan-2-ol
CID 106932260
1-(2-hydroxypropylamino)propan-2-ol;methane
CID 161456696
1-(2-hydroxypropylamino)propan-2-ol;zinc
CID 175137712
1-(dimethylamino)-3-[[(2R)-2-hydroxypropyl]amino]-2-methylpropan-2-ol
CID 106147817
4-(2,2-dimethylpropylamino)-3-methylbutan-1-ol
CID 66091312
N-[1-[[(2R)-2-hydroxypropyl]amino]-2-methylpropan-2-yl]methanesulfonamide
CID 106932132
N-(2,2-dimethylpropyl)-N',2-dimethylpropane-1,3-diamine
CID 79201734
1-(hydroxymethylamino)propan-2-ol
CID 3018672
(2R)-1-(2-methylpropylamino)propan-2-ol
CID 777887
1-N-(2,2-dimethylpropyl)-3-methylpentane-1,2-diamine
CID 61168462

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylpropylamino)propan-2-ol?
The IUPAC name of 1-(2,2-dimethylpropylamino)propan-2-ol (CID 21304828) is 1-(2,2-dimethylpropylamino)propan-2-ol.
What is the SMILES notation for 1-(2,2-dimethylpropylamino)propan-2-ol?
The canonical SMILES for 1-(2,2-dimethylpropylamino)propan-2-ol is CC(O)CNCC(C)(C)C.
What is the InChIKey of 1-(2,2-dimethylpropylamino)propan-2-ol?
The InChIKey is QDLVIRCXZMYKKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-7(10)5-9-6-8(2,3)4/h7,9-10H,5-6H2,1-4H3.
What are the key properties of 1-(2,2-dimethylpropylamino)propan-2-ol?
1-(2,2-dimethylpropylamino)propan-2-ol has a molecular weight of 145.25 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylpropylamino)propan-2-ol is sourced from PubChem (CID 21304828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).