(1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol

C19H25NO — CID 69271499

IUPAC(1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol
SMILESNC[C@@H](c1cccc2ccccc12)[C@H](O)C1CCCCC1
InChIInChI=1S/C19H25NO/c20-13-18(19(21)15-8-2-1-3-9-15)17-12-6-10-14-7-4-5-11-16(14)17/h4-7,10-12,15,18-19,21H,1-3,8-9,13,20H2/t18-,19+/m0/s1
InChIKeyCKLVDGFONUGBFR-RBUKOAKNSA-N
MW283.41 g/mol
LogP3.82
Rot. Bonds4

About (1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol

(1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol (PubChem CID 69271499) has the molecular formula C19H25NO and a molecular weight of 283.41 g/mol. Its IUPAC name is (1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol.

Molecular Properties

Compound Name(1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol
PubChem CID69271499
Molecular FormulaC19H25NO
Molecular Weight283.41 g/mol
Exact Mass283.19
IUPAC Name(1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol
SMILESNC[C@@H](c1cccc2ccccc12)[C@H](O)C1CCCCC1
InChIInChI=1S/C19H25NO/c20-13-18(19(21)15-8-2-1-3-9-15)17-12-6-10-14-7-4-5-11-16(14)17/h4-7,10-12,15,18-19,21H,1-3,8-9,13,20H2/t18-,19+/m0/s1
InChIKeyCKLVDGFONUGBFR-RBUKOAKNSA-N
XLogP3.82
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.41
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-2-(2-bromophenyl)-1-cyclohexylpropan-1-ol
CID 65189456
3-amino-1-cyclopentyl-2-(2-methoxyphenyl)propan-1-ol
CID 65190124
3-amino-1-cyclohexyl-2-(2,4-dichlorophenyl)propan-1-ol
CID 65185454
3-amino-1-cyclooctyl-2-(2,4-dichlorophenyl)propan-1-ol
CID 65185302
2-cyclohexyl-2-methoxy-1-naphthalen-1-ylethanol
CID 116756473
2-cycloheptyl-1-naphthalen-1-ylethanamine
CID 114457695
(R)-cyclobutyl(naphthalen-1-yl)methanamine;hydrochloride
CID 171212042
(1S,2R)-2-amino-1-cyclopentyl-2-phenanthren-9-ylethanol
CID 171264796
N-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine
CID 43079199
3-amino-1-cyclooctyl-2-(4-methylphenyl)propan-1-ol
CID 65187996
[cyclohexyl(naphthalen-1-yl)methyl] acetate
CID 150589052
2-cyclohexylsulfanyl-1-naphthalen-1-ylethanol
CID 65139691

Frequently Asked Questions

What is the IUPAC name of (1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol?
The IUPAC name of (1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol (CID 69271499) is (1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol.
What is the SMILES notation for (1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol?
The canonical SMILES for (1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol is NC[C@@H](c1cccc2ccccc12)[C@H](O)C1CCCCC1.
What is the InChIKey of (1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol?
The InChIKey is CKLVDGFONUGBFR-RBUKOAKNSA-N. The full InChI is InChI=1S/C19H25NO/c20-13-18(19(21)15-8-2-1-3-9-15)17-12-6-10-14-7-4-5-11-16(14)17/h4-7,10-12,15,18-19,21H,1-3,8-9,13,20H2/t18-,19+/m0/s1.
What are the key properties of (1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol?
(1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol has a molecular weight of 283.41 g/mol, XLogP of 3.82, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol is sourced from PubChem (CID 69271499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).