N-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide

C15H20N2O2 — CID 115159450

IUPACN-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide
SMILESCN(C(=O)C1CCNC1)c1ccc2c(c1)CCCO2
InChIInChI=1S/C15H20N2O2/c1-17(15(18)12-6-7-16-10-12)13-4-5-14-11(9-13)3-2-8-19-14/h4-5,9,12,16H,2-3,6-8,10H2,1H3
InChIKeyJSBXTEHBTZQQHP-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.58
Rot. Bonds2

About N-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide

N-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide (PubChem CID 115159450) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide
PubChem CID115159450
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide
SMILESCN(C(=O)C1CCNC1)c1ccc2c(c1)CCCO2
InChIInChI=1S/C15H20N2O2/c1-17(15(18)12-6-7-16-10-12)13-4-5-14-11(9-13)3-2-8-19-14/h4-5,9,12,16H,2-3,6-8,10H2,1H3
InChIKeyJSBXTEHBTZQQHP-UHFFFAOYSA-N
XLogP1.58
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3,4-dihydro-2H-chromen-6-yl(methyl)amino]-2-oxoacetic acid
CID 115141251
3-amino-N-(2,3-dihydro-1-benzofuran-5-yl)-N-methylcyclobutane-1-carboxamide
CID 115161446
N-methyl-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-3-carboxamide
CID 115159432
N-(3,4-dihydro-2H-chromen-6-yl)-2-hydroxy-N,2-dimethylpropanamide
CID 115178677
N-(3,4-difluorophenyl)-N-methylpiperidine-3-carboxamide
CID 115159889
N-(3,4-dihydro-2H-chromen-6-yl)-N-methyl-2-(methylamino)acetamide
CID 82496343
2,3-dihydro-1-benzofuran-5-yl(pyrrolidin-3-yl)methanone
CID 116568338
N-methyl-N-naphthalen-2-ylpiperidine-3-carboxamide
CID 115159907
N-(3H-benzimidazol-5-yl)-N-methylpyrrolidine-3-carboxamide
CID 115159458
3-amino-N-(3,4-dihydro-2H-chromen-6-yl)-N,2,2-trimethylpropanamide
CID 115154596
3-amino-N-(3,4-dihydro-2H-chromen-6-yl)-N,2-dimethylpropanamide
CID 115153584
N-methyl-N-(3-propan-2-ylphenyl)pyrrolidine-3-carboxamide
CID 119752994

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide (CID 115159450) is N-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide is CN(C(=O)C1CCNC1)c1ccc2c(c1)CCCO2.
What is the InChIKey of N-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide?
The InChIKey is JSBXTEHBTZQQHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-17(15(18)12-6-7-16-10-12)13-4-5-14-11(9-13)3-2-8-19-14/h4-5,9,12,16H,2-3,6-8,10H2,1H3.
What are the key properties of N-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide?
N-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-chromen-6-yl)-N-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 115159450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).