trans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol

C9H17NO — CID 130608509

IUPACtrans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol
SMILESCC(N[C@@H]1CC[C@H]1O)C1CC1
InChIInChI=1S/C9H17NO/c1-6(7-2-3-7)10-8-4-5-9(8)11/h6-11H,2-5H2,1H3/t6?,8-,9-/m1/s1
InChIKeyMKVNUXCHZBIRNU-YAMRNFDGSA-N
MW155.24 g/mol
LogP0.90
Rot. Bonds3

About trans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol

trans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol (PubChem CID 130608509) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is trans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol.

Molecular Properties

Compound Nametrans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol
PubChem CID130608509
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Nametrans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol
SMILESCC(N[C@@H]1CC[C@H]1O)C1CC1
InChIInChI=1S/C9H17NO/c1-6(7-2-3-7)10-8-4-5-9(8)11/h6-11H,2-5H2,1H3/t6?,8-,9-/m1/s1
InChIKeyMKVNUXCHZBIRNU-YAMRNFDGSA-N
XLogP0.90
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1R,2R)-2-[[(1S)-1-cyclopropylethyl]amino]cyclohexan-1-ol
CID 124679605
trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol
CID 102733833
2-[[(1R)-1-cycloheptylethyl]amino]cycloheptan-1-ol
CID 81392910
2-[[(1R)-1-cyclopentylethyl]amino]cycloheptan-1-ol
CID 81395053
trans-(1S,2S)-2-(propan-2-ylamino)cyclobutan-1-ol
CID 176810875
4-[[(1R)-1-cyclopentylethyl]amino]oxolan-3-ol
CID 81394183
N-(1-cyclopropylethyl)bicyclo[3.1.0]hexan-2-amine
CID 130496523
N-[(1R)-1-cyclopropylethyl]cyclopropanamine
CID 28819115
N-[(1S)-1-cyclobutylethyl]-2-methylcyclobutan-1-amine
CID 130662747
4-[[(1S)-1-cyclopentylethyl]amino]-1,1-dioxothiolan-3-ol
CID 81394816
cis-(1S,2R)-2-[[(1R)-1-phenylethyl]amino]cyclobutan-1-ol
CID 10609367
N-(1-cyclopropylethyl)cyclopent-3-en-1-amine
CID 115728515

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol?
The IUPAC name of trans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol (CID 130608509) is trans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol.
What is the SMILES notation for trans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol?
The canonical SMILES for trans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol is CC(N[C@@H]1CC[C@H]1O)C1CC1.
What is the InChIKey of trans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol?
The InChIKey is MKVNUXCHZBIRNU-YAMRNFDGSA-N. The full InChI is InChI=1S/C9H17NO/c1-6(7-2-3-7)10-8-4-5-9(8)11/h6-11H,2-5H2,1H3/t6?,8-,9-/m1/s1.
What are the key properties of trans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol?
trans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol has a molecular weight of 155.24 g/mol, XLogP of 0.90, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol is sourced from PubChem (CID 130608509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).