(2S)-1-(cyclopropylamino)propan-2-ol

C6H13NO — CID 39234971

IUPAC(2S)-1-(cyclopropylamino)propan-2-ol
SMILESC[C@H](O)CNC1CC1
InChIInChI=1S/C6H13NO/c1-5(8)4-7-6-2-3-6/h5-8H,2-4H2,1H3/t5-/m0/s1
InChIKeyFLBAPNQECBHZCB-YFKPBYRVSA-N
MW115.18 g/mol
LogP0.12
Rot. Bonds3

About (2S)-1-(cyclopropylamino)propan-2-ol

(2S)-1-(cyclopropylamino)propan-2-ol (PubChem CID 39234971) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is (2S)-1-(cyclopropylamino)propan-2-ol.

Molecular Properties

Compound Name(2S)-1-(cyclopropylamino)propan-2-ol
PubChem CID39234971
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name(2S)-1-(cyclopropylamino)propan-2-ol
SMILESC[C@H](O)CNC1CC1
InChIInChI=1S/C6H13NO/c1-5(8)4-7-6-2-3-6/h5-8H,2-4H2,1H3/t5-/m0/s1
InChIKeyFLBAPNQECBHZCB-YFKPBYRVSA-N
XLogP0.12
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclooctylamino)propan-2-ol
CID 20539535
1-(cycloheptylamino)propan-2-ol
CID 43392225
(2R)-1-[(4-propylcyclohexyl)amino]propan-2-ol
CID 93033312
(2R)-1-[(1-propan-2-ylpiperidin-4-yl)amino]propan-2-ol
CID 93033302
(2R)-1-[(1-iodopiperidin-4-yl)amino]propan-2-ol
CID 134342012
(2R)-1-[[(1S,3S,4R)-3,4-dimethylcyclohexyl]amino]propan-2-ol
CID 96732492
1-(oxetan-3-ylamino)propan-2-ol
CID 63624382
(2S)-1-(cyclopent-3-en-1-ylamino)propan-2-ol
CID 106932543
(2R)-1-[(1-tert-butylpiperidin-4-yl)amino]propan-2-ol
CID 103906834
1-(azepan-4-ylamino)propan-2-ol
CID 103980928
(2S)-1-[[(3S)-thiolan-3-yl]amino]propan-2-ol
CID 93033310
4-(2-methylpropylamino)cyclohexan-1-ol
CID 8024862

Frequently Asked Questions

What is the IUPAC name of (2S)-1-(cyclopropylamino)propan-2-ol?
The IUPAC name of (2S)-1-(cyclopropylamino)propan-2-ol (CID 39234971) is (2S)-1-(cyclopropylamino)propan-2-ol.
What is the SMILES notation for (2S)-1-(cyclopropylamino)propan-2-ol?
The canonical SMILES for (2S)-1-(cyclopropylamino)propan-2-ol is C[C@H](O)CNC1CC1.
What is the InChIKey of (2S)-1-(cyclopropylamino)propan-2-ol?
The InChIKey is FLBAPNQECBHZCB-YFKPBYRVSA-N. The full InChI is InChI=1S/C6H13NO/c1-5(8)4-7-6-2-3-6/h5-8H,2-4H2,1H3/t5-/m0/s1.
What are the key properties of (2S)-1-(cyclopropylamino)propan-2-ol?
(2S)-1-(cyclopropylamino)propan-2-ol has a molecular weight of 115.18 g/mol, XLogP of 0.12, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-(cyclopropylamino)propan-2-ol is sourced from PubChem (CID 39234971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).