(3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol

C15H17NO — CID 10823187

IUPAC(3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol
SMILESO[C@@H]1CCN(Cc2cccc3ccccc23)C1
InChIInChI=1S/C15H17NO/c17-14-8-9-16(11-14)10-13-6-3-5-12-4-1-2-7-15(12)13/h1-7,14,17H,8-11H2/t14-/m1/s1
InChIKeyJODYTCKSOYYQBT-CQSZACIVSA-N
MW227.31 g/mol
LogP2.41
Rot. Bonds2

About (3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol

(3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol (PubChem CID 10823187) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is (3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol.

Molecular Properties

Compound Name(3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol
PubChem CID10823187
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name(3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol
SMILESO[C@@H]1CCN(Cc2cccc3ccccc23)C1
InChIInChI=1S/C15H17NO/c17-14-8-9-16(11-14)10-13-6-3-5-12-4-1-2-7-15(12)13/h1-7,14,17H,8-11H2/t14-/m1/s1
InChIKeyJODYTCKSOYYQBT-CQSZACIVSA-N
XLogP2.41
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-1-(naphthalen-1-ylmethyl)piperidin-4-ol
CID 114511208
3-bromo-1-(naphthalen-1-ylmethyl)pyrrolidine
CID 80675511
(3S)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-amine
CID 10680771
3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine
CID 23396966
N-methyl-1-(naphthalen-1-ylmethyl)pyrrolidin-3-amine
CID 62369278
3-(naphthalen-1-ylmethyl)-3,9-diazabicyclo[4.2.1]nonane
CID 81495523
1,4-bis(naphthalen-1-ylmethyl)piperazine
CID 4846171
3-chloro-1-(naphthalen-1-ylmethyl)piperidine
CID 55182607
1-[(2-methoxyphenyl)methyl]pyrrolidin-3-ol
CID 24904459
1-[1-(naphthalen-1-ylmethyl)pyrrolidin-3-yl]ethanamine
CID 112630234
(3S)-1-[(3-chloro-2-methylphenyl)methyl]pyrrolidin-3-ol
CID 93478443
N,3-dimethyl-1-(naphthalen-1-ylmethyl)piperidin-4-amine
CID 62369775

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol?
The IUPAC name of (3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol (CID 10823187) is (3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol.
What is the SMILES notation for (3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol?
The canonical SMILES for (3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol is O[C@@H]1CCN(Cc2cccc3ccccc23)C1.
What is the InChIKey of (3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol?
The InChIKey is JODYTCKSOYYQBT-CQSZACIVSA-N. The full InChI is InChI=1S/C15H17NO/c17-14-8-9-16(11-14)10-13-6-3-5-12-4-1-2-7-15(12)13/h1-7,14,17H,8-11H2/t14-/m1/s1.
What are the key properties of (3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol?
(3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol has a molecular weight of 227.31 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol is sourced from PubChem (CID 10823187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).