N-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide

C13H14N4O2 — CID 71789966

IUPACN-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide
SMILESO=C(Nc1cnc(N2CCCC2)nc1)c1ccco1
InChIInChI=1S/C13H14N4O2/c18-12(11-4-3-7-19-11)16-10-8-14-13(15-9-10)17-5-1-2-6-17/h3-4,7-9H,1-2,5-6H2,(H,16,18)
InChIKeyOTCRPKKMHVQKIH-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.92
Rot. Bonds3

About N-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide

N-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide (PubChem CID 71789966) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is N-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide
PubChem CID71789966
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC NameN-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide
SMILESO=C(Nc1cnc(N2CCCC2)nc1)c1ccco1
InChIInChI=1S/C13H14N4O2/c18-12(11-4-3-7-19-11)16-10-8-14-13(15-9-10)17-5-1-2-6-17/h3-4,7-9H,1-2,5-6H2,(H,16,18)
InChIKeyOTCRPKKMHVQKIH-UHFFFAOYSA-N
XLogP1.92
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,6-difluoro-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)benzamide
CID 53164645
N-[4-[(4-piperidin-1-ylphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 26243989
N-[6-(4-pyridin-2-ylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide
CID 113014476
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232
N-[2-methyl-5-[(6-pyrrolidin-1-yl-3-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide
CID 30266978
2-methyl-N-(2-piperidin-1-ylpyrimidin-5-yl)benzamide
CID 53014761
N-(2-piperidin-1-ylpyrimidin-5-yl)isoquinoline-1-carboxamide
CID 122298631
N-[2-oxo-2-[(6-piperidin-1-yl-3-pyridinyl)amino]ethyl]furan-2-carboxamide
CID 18144018
N-[4-[(1-pyrimidin-2-ylpiperidin-4-yl)carbamoyl]phenyl]furan-2-carboxamide
CID 55705433
N-(6-chloro-3-pyridinyl)furan-2-carboxamide
CID 54787856
3-fluoro-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)benzamide
CID 53014754
4-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)chromene-2-carboxamide
CID 122298602

Frequently Asked Questions

What is the IUPAC name of N-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide?
The IUPAC name of N-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide (CID 71789966) is N-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide.
What is the SMILES notation for N-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide?
The canonical SMILES for N-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide is O=C(Nc1cnc(N2CCCC2)nc1)c1ccco1.
What is the InChIKey of N-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide?
The InChIKey is OTCRPKKMHVQKIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c18-12(11-4-3-7-19-11)16-10-8-14-13(15-9-10)17-5-1-2-6-17/h3-4,7-9H,1-2,5-6H2,(H,16,18).
What are the key properties of N-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide?
N-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide is sourced from PubChem (CID 71789966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).