N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide

C15H18N6O — CID 126818265

IUPACN-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide
SMILESO=C(Nc1cccnc1N1CCCC1)N1CCn2ccnc21
InChIInChI=1S/C15H18N6O/c22-15(21-11-10-20-9-6-17-14(20)21)18-12-4-3-5-16-13(12)19-7-1-2-8-19/h3-6,9H,1-2,7-8,10-11H2,(H,18,22)
InChIKeyOMTSCLHCUSWDCU-UHFFFAOYSA-N
MW298.35 g/mol
LogP1.93
Rot. Bonds2

About N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide

N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide (PubChem CID 126818265) has the molecular formula C15H18N6O and a molecular weight of 298.35 g/mol. Its IUPAC name is N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide.

Molecular Properties

Compound NameN-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide
PubChem CID126818265
Molecular FormulaC15H18N6O
Molecular Weight298.35 g/mol
Exact Mass298.15
IUPAC NameN-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide
SMILESO=C(Nc1cccnc1N1CCCC1)N1CCn2ccnc21
InChIInChI=1S/C15H18N6O/c22-15(21-11-10-20-9-6-17-14(20)21)18-12-4-3-5-16-13(12)19-7-1-2-8-19/h3-6,9H,1-2,7-8,10-11H2,(H,18,22)
InChIKeyOMTSCLHCUSWDCU-UHFFFAOYSA-N
XLogP1.93
TPSA66.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide?
The IUPAC name of N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide (CID 126818265) is N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide.
What is the SMILES notation for N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide?
The canonical SMILES for N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide is O=C(Nc1cccnc1N1CCCC1)N1CCn2ccnc21.
What is the InChIKey of N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide?
The InChIKey is OMTSCLHCUSWDCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6O/c22-15(21-11-10-20-9-6-17-14(20)21)18-12-4-3-5-16-13(12)19-7-1-2-8-19/h3-6,9H,1-2,7-8,10-11H2,(H,18,22).
What are the key properties of N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide?
N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide has a molecular weight of 298.35 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide is sourced from PubChem (CID 126818265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).