4-amino-3-cyclobutyl-3-methylbutan-1-ol

C9H19NO — CID 131219729

IUPAC4-amino-3-cyclobutyl-3-methylbutan-1-ol
SMILESCC(CN)(CCO)C1CCC1
InChIInChI=1S/C9H19NO/c1-9(7-10,5-6-11)8-3-2-4-8/h8,11H,2-7,10H2,1H3
InChIKeyWWMNKXHYLVSIKN-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.13
Rot. Bonds4

About 4-amino-3-cyclobutyl-3-methylbutan-1-ol

4-amino-3-cyclobutyl-3-methylbutan-1-ol (PubChem CID 131219729) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 4-amino-3-cyclobutyl-3-methylbutan-1-ol.

Molecular Properties

Compound Name4-amino-3-cyclobutyl-3-methylbutan-1-ol
PubChem CID131219729
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name4-amino-3-cyclobutyl-3-methylbutan-1-ol
SMILESCC(CN)(CCO)C1CCC1
InChIInChI=1S/C9H19NO/c1-9(7-10,5-6-11)8-3-2-4-8/h8,11H,2-7,10H2,1H3
InChIKeyWWMNKXHYLVSIKN-UHFFFAOYSA-N
XLogP1.13
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopentyl-3-fluoro-2-methylpropan-1-amine
CID 83815658
3-amino-3-cyclopropylbutan-1-ol
CID 65240189
(2R)-1-amino-2-cyclopentylpropan-2-ol
CID 94524784
4-cyclobutylpentane-1,4-diol
CID 116861653
5-amino-2-cyclobutylpentan-2-ol
CID 130580664
3-cyclohexyl-2-cyclopropyl-2-methylpropan-1-amine
CID 83149608
2-cycloheptyl-2-methylpropan-1-amine
CID 82934909
2-cyclohexyl-2-methylpropan-1-amine
CID 19776368
3-amino-2-cyclobutyl-2-methylpropanoic acid
CID 106487162
(2S)-1-amino-2-cyclohexylpropan-2-ol
CID 93298138
4-amino-3,3-dimethylbutan-1-ol
CID 55290156
5-cyclohexyl-5-methylnonanediamide
CID 70542890

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-cyclobutyl-3-methylbutan-1-ol?
The IUPAC name of 4-amino-3-cyclobutyl-3-methylbutan-1-ol (CID 131219729) is 4-amino-3-cyclobutyl-3-methylbutan-1-ol.
What is the SMILES notation for 4-amino-3-cyclobutyl-3-methylbutan-1-ol?
The canonical SMILES for 4-amino-3-cyclobutyl-3-methylbutan-1-ol is CC(CN)(CCO)C1CCC1.
What is the InChIKey of 4-amino-3-cyclobutyl-3-methylbutan-1-ol?
The InChIKey is WWMNKXHYLVSIKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-9(7-10,5-6-11)8-3-2-4-8/h8,11H,2-7,10H2,1H3.
What are the key properties of 4-amino-3-cyclobutyl-3-methylbutan-1-ol?
4-amino-3-cyclobutyl-3-methylbutan-1-ol has a molecular weight of 157.26 g/mol, XLogP of 1.13, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-cyclobutyl-3-methylbutan-1-ol is sourced from PubChem (CID 131219729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).