(2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol

C14H21NO — CID 103778498

IUPAC(2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol
SMILESC[C@H](CO)NC(Cc1ccccc1)C1CC1
InChIInChI=1S/C14H21NO/c1-11(10-16)15-14(13-7-8-13)9-12-5-3-2-4-6-12/h2-6,11,13-16H,7-10H2,1H3/t11-,14?/m1/s1
InChIKeyHJFZDFFUUQIDQX-YNODCEANSA-N
MW219.33 g/mol
LogP1.98
Rot. Bonds6

About (2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol

(2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol (PubChem CID 103778498) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is (2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol.

Molecular Properties

Compound Name(2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol
PubChem CID103778498
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name(2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol
SMILESC[C@H](CO)NC(Cc1ccccc1)C1CC1
InChIInChI=1S/C14H21NO/c1-11(10-16)15-14(13-7-8-13)9-12-5-3-2-4-6-12/h2-6,11,13-16H,7-10H2,1H3/t11-,14?/m1/s1
InChIKeyHJFZDFFUUQIDQX-YNODCEANSA-N
XLogP1.98
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-((1-Phenylethyl)amino)ethan-1-ol
CID 14909
N-Phenethylethanolamine
CID 17826
2-(6-(((1R,2S)-2-((E)-1-phenylbut-1-en-2-yl)cyclopropyl)amino)-2-azaspiro[3.3]heptan-2-yl)ethanol
CID 134468925
2-[2-[[(1R,2S)-2-[(E)-1-phenylbut-1-en-2-yl]cyclopropyl]amino]-7-azaspiro[3.5]nonan-7-yl]ethanol
CID 134468943
2-(Benzylamino)propan-1-ol
CID 138873
(R)-2-(benzylamino)butan-1-ol
CID 927306
2-[[3-(4-tert-Butylphenyl)-2-methylpropyl]amino]ethanol
CID 139596372
1-[[3-(4-tert-Butylphenyl)-2-methylpropyl]amino]propan-2-ol
CID 139598047
2-[(3-Phenyl-2-propyn-1-yl)amino]-1-butanol hydrochloride
CID 2958354
(2R)-3-phenyl-2-(tetradecylamino)propan-1-ol;hydrochloride
CID 49797463
(2R)-N-(cyclopropylmethyl)-1-phenylpropan-2-amine
CID 53707349
2-[[4-[[(1R,2S)-2-[(E)-1-phenylprop-1-en-2-yl]cyclopropyl]amino]cyclohexyl]amino]ethanol
CID 122649223

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol?
The IUPAC name of (2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol (CID 103778498) is (2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol.
What is the SMILES notation for (2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol?
The canonical SMILES for (2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol is C[C@H](CO)NC(Cc1ccccc1)C1CC1.
What is the InChIKey of (2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol?
The InChIKey is HJFZDFFUUQIDQX-YNODCEANSA-N. The full InChI is InChI=1S/C14H21NO/c1-11(10-16)15-14(13-7-8-13)9-12-5-3-2-4-6-12/h2-6,11,13-16H,7-10H2,1H3/t11-,14?/m1/s1.
What are the key properties of (2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol?
(2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol has a molecular weight of 219.33 g/mol, XLogP of 1.98, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(1-cyclopropyl-2-phenylethyl)amino]propan-1-ol is sourced from PubChem (CID 103778498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).