2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol

C17H21NO — CID 15617933

IUPAC2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol
SMILESOc1c(CCCN2CCCC2)ccc2ccccc12
InChIInChI=1S/C17H21NO/c19-17-15(7-5-13-18-11-3-4-12-18)10-9-14-6-1-2-8-16(14)17/h1-2,6,8-10,19H,3-5,7,11-13H2
InChIKeyZAZANORLPAHLLL-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.57
Rot. Bonds4

About 2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol

2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol (PubChem CID 15617933) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol.

Molecular Properties

Compound Name2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol
PubChem CID15617933
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol
SMILESOc1c(CCCN2CCCC2)ccc2ccccc12
InChIInChI=1S/C17H21NO/c19-17-15(7-5-13-18-11-3-4-12-18)10-9-14-6-1-2-8-16(14)17/h1-2,6,8-10,19H,3-5,7,11-13H2
InChIKeyZAZANORLPAHLLL-UHFFFAOYSA-N
XLogP3.57
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-pyrrolidin-1-ylethyl)naphthalen-1-ol
CID 174438456
2-undecylnaphthalen-1-ol
CID 139729579
2-[2-(2-piperidin-1-ylethyl)naphthalen-1-yl]acetic acid;hydrochloride
CID 21127072
2-(3-piperidin-1-ylpropyl)aniline
CID 28721004
2-(cyclohexylmethyl)naphthalen-1-ol
CID 15617835
10-(1-hydroxynaphthalen-2-yl)decanoic acid
CID 151914986
[2-(3-piperidin-1-ylpropyl)quinolin-3-yl]methanol
CID 152553569
2-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]naphthalen-1-ol
CID 23541393
1,4,7,10-tetrakis(4-pyren-1-ylbutyl)-1,4,7,10-tetrazacyclododecane
CID 132500241
1-[(2R)-2-ethyl-1,4-oxazepan-4-yl]-3-(1-hydroxynaphthalen-2-yl)propan-1-one
CID 125144462
1-[2-(2-propylnaphthalen-1-yl)oxyethyl]piperidine chloride
CID 21228753
1-naphthalen-1-yl-6-piperidin-1-ylhexan-1-one
CID 54160942

Frequently Asked Questions

What is the IUPAC name of 2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol?
The IUPAC name of 2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol (CID 15617933) is 2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol.
What is the SMILES notation for 2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol?
The canonical SMILES for 2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol is Oc1c(CCCN2CCCC2)ccc2ccccc12.
What is the InChIKey of 2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol?
The InChIKey is ZAZANORLPAHLLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c19-17-15(7-5-13-18-11-3-4-12-18)10-9-14-6-1-2-8-16(14)17/h1-2,6,8-10,19H,3-5,7,11-13H2.
What are the key properties of 2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol?
2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol has a molecular weight of 255.36 g/mol, XLogP of 3.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-pyrrolidin-1-ylpropyl)naphthalen-1-ol is sourced from PubChem (CID 15617933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).