1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide

C16H16N2O3 — CID 11492936

IUPAC1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide
SMILESNC(=O)C1CCCN1C(=O)c1cc2ccccc2cc1O
InChIInChI=1S/C16H16N2O3/c17-15(20)13-6-3-7-18(13)16(21)12-8-10-4-1-2-5-11(10)9-14(12)19/h1-2,4-5,8-9,13,19H,3,6-7H2,(H2,17,20)
InChIKeyIOKIPYUSTYYCRF-UHFFFAOYSA-N
MW284.31 g/mol
LogP1.64
Rot. Bonds2

About 1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide

1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide (PubChem CID 11492936) has the molecular formula C16H16N2O3 and a molecular weight of 284.31 g/mol. Its IUPAC name is 1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide
PubChem CID11492936
Molecular FormulaC16H16N2O3
Molecular Weight284.31 g/mol
Exact Mass284.12
IUPAC Name1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide
SMILESNC(=O)C1CCCN1C(=O)c1cc2ccccc2cc1O
InChIInChI=1S/C16H16N2O3/c17-15(20)13-6-3-7-18(13)16(21)12-8-10-4-1-2-5-11(10)9-14(12)19/h1-2,4-5,8-9,13,19H,3,6-7H2,(H2,17,20)
InChIKeyIOKIPYUSTYYCRF-UHFFFAOYSA-N
XLogP1.64
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-carbamoylpyrrolidine-1-carbonyl)benzoic acid
CID 43396532
(2,3-dimethylpiperidin-1-yl)-(3-hydroxynaphthalen-2-yl)methanone
CID 62122713
1-(2,5-dihydroxybenzoyl)piperidine-2-carboxamide
CID 107722668
1-(2-fluorobenzoyl)pyrrolidine-2-carboxamide
CID 60659210
1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide
CID 54943176
(2-ethylpiperidin-1-yl)-(3-hydroxynaphthalen-2-yl)methanone
CID 43403986
1-(4-hydroxybenzoyl)pyrrolidine-2-carboxamide
CID 43212216
(2R)-1-(5-bromo-2-chlorobenzoyl)pyrrolidine-2-carboxamide
CID 93418929
(3-hydroxynaphthalen-2-yl)-(4-methylazepan-1-yl)methanone
CID 62045780
(2S)-1-(4-methoxybenzoyl)pyrrolidine-2-carboxamide
CID 110867482
1-(2,4-dihydroxybenzoyl)piperidine-2-carbothioamide
CID 107722124
1-(1-benzylindole-2-carbonyl)pyrrolidine-2-carboxamide
CID 56726565

Frequently Asked Questions

What is the IUPAC name of 1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide (CID 11492936) is 1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide is NC(=O)C1CCCN1C(=O)c1cc2ccccc2cc1O.
What is the InChIKey of 1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide?
The InChIKey is IOKIPYUSTYYCRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c17-15(20)13-6-3-7-18(13)16(21)12-8-10-4-1-2-5-11(10)9-14(12)19/h1-2,4-5,8-9,13,19H,3,6-7H2,(H2,17,20).
What are the key properties of 1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide?
1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide has a molecular weight of 284.31 g/mol, XLogP of 1.64, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 11492936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).