(2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol

C10H21NO — CID 96784285

IUPAC(2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol
SMILESC[C@H]1CC[C@H](NCC[C@@H](C)O)C1
InChIInChI=1S/C10H21NO/c1-8-3-4-10(7-8)11-6-5-9(2)12/h8-12H,3-7H2,1-2H3/t8-,9+,10-/m0/s1
InChIKeyGXZZAGNHZIDJGO-AEJSXWLSSA-N
MW171.28 g/mol
LogP1.54
Rot. Bonds4

About (2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol

(2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol (PubChem CID 96784285) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is (2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol.

Molecular Properties

Compound Name(2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol
PubChem CID96784285
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name(2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol
SMILESC[C@H]1CC[C@H](NCC[C@@H](C)O)C1
InChIInChI=1S/C10H21NO/c1-8-3-4-10(7-8)11-6-5-9(2)12/h8-12H,3-7H2,1-2H3/t8-,9+,10-/m0/s1
InChIKeyGXZZAGNHZIDJGO-AEJSXWLSSA-N
XLogP1.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol with MolForge

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Related Compounds

(2S)-4-[[(1S,3R)-3-methylcyclopentyl]amino]butan-2-ol
CID 124674906
(2R)-4-[[(3S,5S)-3,5-dimethylcyclohexyl]amino]butan-2-ol
CID 96784232
1-N-(3-methylcyclopentyl)hexane-1,3-diamine
CID 114547292
4-[(2,6-dimethyloxan-4-yl)amino]butan-2-ol
CID 75525282
4-[(3-ethylcyclohexyl)amino]butan-2-ol
CID 64910708
5-[(4-methylcycloheptyl)amino]pentan-2-ol
CID 106121910
4-[(4,4-dimethylcyclohexyl)amino]butan-2-ol
CID 64913852
3-methyl-N-(2-propan-2-ylsulfonylethyl)cyclopentan-1-amine
CID 106724576
(1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine
CID 71032236
3-methyl-N-(3-methylbut-3-enyl)cyclopentan-1-amine
CID 114545737
3-methyl-N-octylcyclopentan-1-amine
CID 115566670
1-N-(3-methylcyclopentyl)propane-1,2-diamine
CID 114547299

Frequently Asked Questions

What is the IUPAC name of (2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol?
The IUPAC name of (2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol (CID 96784285) is (2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol.
What is the SMILES notation for (2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol?
The canonical SMILES for (2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol is C[C@H]1CC[C@H](NCC[C@@H](C)O)C1.
What is the InChIKey of (2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol?
The InChIKey is GXZZAGNHZIDJGO-AEJSXWLSSA-N. The full InChI is InChI=1S/C10H21NO/c1-8-3-4-10(7-8)11-6-5-9(2)12/h8-12H,3-7H2,1-2H3/t8-,9+,10-/m0/s1.
What are the key properties of (2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol?
(2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol has a molecular weight of 171.28 g/mol, XLogP of 1.54, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol is sourced from PubChem (CID 96784285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).