(2S)-1-cyclobutylpropan-2-amine

C7H15N — CID 66713874

IUPAC(2S)-1-cyclobutylpropan-2-amine
SMILESC[C@H](N)CC1CCC1
InChIInChI=1S/C7H15N/c1-6(8)5-7-3-2-4-7/h6-7H,2-5,8H2,1H3/t6-/m0/s1
InChIKeyGPEFCRXOFGOZFQ-LURJTMIESA-N
MW113.20 g/mol
LogP1.52
Rot. Bonds2

About (2S)-1-cyclobutylpropan-2-amine

(2S)-1-cyclobutylpropan-2-amine (PubChem CID 66713874) has the molecular formula C7H15N and a molecular weight of 113.20 g/mol. Its IUPAC name is (2S)-1-cyclobutylpropan-2-amine.

Molecular Properties

Compound Name(2S)-1-cyclobutylpropan-2-amine
PubChem CID66713874
Molecular FormulaC7H15N
Molecular Weight113.20 g/mol
Exact Mass113.12
IUPAC Name(2S)-1-cyclobutylpropan-2-amine
SMILESC[C@H](N)CC1CCC1
InChIInChI=1S/C7H15N/c1-6(8)5-7-3-2-4-7/h6-7H,2-5,8H2,1H3/t6-/m0/s1
InChIKeyGPEFCRXOFGOZFQ-LURJTMIESA-N
XLogP1.52
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.20
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-1-cyclobutylpropan-2-amine
CID 124506916
(2S)-1-(4-methylcyclohexyl)propan-2-amine
CID 163792436
(2S)-1-(oxan-4-yl)propan-2-amine
CID 94422387
1-(oxan-4-yl)propan-2-amine
CID 21054632
(4R)-4-(cyclobutylmethyl)-5-methylhexan-2-amine
CID 89058597
(2S)-1-(thian-3-yl)propan-2-amine
CID 157129438
1-(oxan-3-yl)propan-2-amine
CID 63737520
(2S,3R)-3-amino-1-cyclobutylbutan-2-ol
CID 124673545
1-cyclobutyl-3-fluorobutan-2-amine
CID 84649039
1-(1-oxothian-4-yl)propan-2-amine
CID 142227478
2-cyclopropylpropylcyclobutane
CID 54087952
1,2-di(cyclobutyl)ethanamine
CID 65456758

Frequently Asked Questions

What is the IUPAC name of (2S)-1-cyclobutylpropan-2-amine?
The IUPAC name of (2S)-1-cyclobutylpropan-2-amine (CID 66713874) is (2S)-1-cyclobutylpropan-2-amine.
What is the SMILES notation for (2S)-1-cyclobutylpropan-2-amine?
The canonical SMILES for (2S)-1-cyclobutylpropan-2-amine is C[C@H](N)CC1CCC1.
What is the InChIKey of (2S)-1-cyclobutylpropan-2-amine?
The InChIKey is GPEFCRXOFGOZFQ-LURJTMIESA-N. The full InChI is InChI=1S/C7H15N/c1-6(8)5-7-3-2-4-7/h6-7H,2-5,8H2,1H3/t6-/m0/s1.
What are the key properties of (2S)-1-cyclobutylpropan-2-amine?
(2S)-1-cyclobutylpropan-2-amine has a molecular weight of 113.20 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-cyclobutylpropan-2-amine is sourced from PubChem (CID 66713874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).