1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol

C9H19NO — CID 103565540

IUPAC1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol
SMILESCC(C)C1CC(O)(CCN)C1
InChIInChI=1S/C9H19NO/c1-7(2)8-5-9(11,6-8)3-4-10/h7-8,11H,3-6,10H2,1-2H3
InChIKeyYQPORPONORQERI-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.13
Rot. Bonds3

About 1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol

1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol (PubChem CID 103565540) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol.

Molecular Properties

Compound Name1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol
PubChem CID103565540
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol
SMILESCC(C)C1CC(O)(CCN)C1
InChIInChI=1S/C9H19NO/c1-7(2)8-5-9(11,6-8)3-4-10/h7-8,11H,3-6,10H2,1-2H3
InChIKeyYQPORPONORQERI-UHFFFAOYSA-N
XLogP1.13
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
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

1-(3-methoxypropyl)-3-propan-2-ylcyclobutan-1-ol
CID 103564186
1-(1-amino-2-methylpropan-2-yl)-3-propan-2-ylcyclobutan-1-ol
CID 103565553
1-(2-aminoethyl)-3-ethoxycyclobutan-1-ol
CID 106824789
1-(cyclohexylmethyl)-3-propan-2-ylcyclobutan-1-ol
CID 103563992
2-(1-amino-3-propan-2-ylcyclobutyl)ethanol
CID 103565314
3-propan-2-yl-1-[(2,4,6-trimethylphenyl)methyl]cyclobutan-1-ol
CID 103564047
3-(2-aminoethyl)-1-propan-2-ylpyrrolidin-3-ol
CID 82503311
1-pentan-2-yl-3-propan-2-ylcyclobutan-1-ol
CID 107892837
1-[(2-amino-3-pyridinyl)methyl]-3-propan-2-ylcyclobutan-1-ol
CID 103563985
1,1-diethyl-3-propan-2-ylcyclobutane
CID 162172993
2-(1-amino-3-propan-2-ylcyclobutyl)acetic acid
CID 103565035
1-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)-3-propan-2-ylcyclobutan-1-amine
CID 103562758

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol?
The IUPAC name of 1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol (CID 103565540) is 1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol.
What is the SMILES notation for 1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol?
The canonical SMILES for 1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol is CC(C)C1CC(O)(CCN)C1.
What is the InChIKey of 1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol?
The InChIKey is YQPORPONORQERI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-7(2)8-5-9(11,6-8)3-4-10/h7-8,11H,3-6,10H2,1-2H3.
What are the key properties of 1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol?
1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol has a molecular weight of 157.26 g/mol, XLogP of 1.13, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminoethyl)-3-propan-2-ylcyclobutan-1-ol is sourced from PubChem (CID 103565540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).