N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide

C16H17N5O — CID 129329951

IUPACN-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide
SMILESO=C(NC[C@@H]1CCc2nccn2C1)c1cccc2nccn12
InChIInChI=1S/C16H17N5O/c22-16(13-2-1-3-15-18-7-9-21(13)15)19-10-12-4-5-14-17-6-8-20(14)11-12/h1-3,6-9,12H,4-5,10-11H2,(H,19,22)/t12-/m0/s1
InChIKeyHDGPWCOIVWYOJF-LBPRGKRZSA-N
MW295.35 g/mol
LogP1.52
Rot. Bonds3

About N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide

N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide (PubChem CID 129329951) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide
PubChem CID129329951
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC NameN-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide
SMILESO=C(NC[C@@H]1CCc2nccn2C1)c1cccc2nccn12
InChIInChI=1S/C16H17N5O/c22-16(13-2-1-3-15-18-7-9-21(13)15)19-10-12-4-5-14-17-6-8-20(14)11-12/h1-3,6-9,12H,4-5,10-11H2,(H,19,22)/t12-/m0/s1
InChIKeyHDGPWCOIVWYOJF-LBPRGKRZSA-N
XLogP1.52
TPSA64.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide?
The IUPAC name of N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide (CID 129329951) is N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide.
What is the SMILES notation for N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide?
The canonical SMILES for N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide is O=C(NC[C@@H]1CCc2nccn2C1)c1cccc2nccn12.
What is the InChIKey of N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide?
The InChIKey is HDGPWCOIVWYOJF-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H17N5O/c22-16(13-2-1-3-15-18-7-9-21(13)15)19-10-12-4-5-14-17-6-8-20(14)11-12/h1-3,6-9,12H,4-5,10-11H2,(H,19,22)/t12-/m0/s1.
What are the key properties of N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide?
N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide has a molecular weight of 295.35 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide is sourced from PubChem (CID 129329951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).