2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide

C25H25N5O2 — CID 167950597

IUPAC2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide
SMILESCC(c1ccccc1)n1c(NC(=O)c2cccnc2N2CCOCC2)nc2ccccc21
InChIInChI=1S/C25H25N5O2/c1-18(19-8-3-2-4-9-19)30-22-12-6-5-11-21(22)27-25(30)28-24(31)20-10-7-13-26-23(20)29-14-16-32-17-15-29/h2-13,18H,14-17H2,1H3,(H,27,28,31)
InChIKeyDHGRHLFZPSOMQB-UHFFFAOYSA-N
MW427.51 g/mol
LogP4.13
Rot. Bonds5

About 2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide

2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide (PubChem CID 167950597) has the molecular formula C25H25N5O2 and a molecular weight of 427.51 g/mol. Its IUPAC name is 2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide
PubChem CID167950597
Molecular FormulaC25H25N5O2
Molecular Weight427.51 g/mol
Exact Mass427.20
IUPAC Name2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide
SMILESCC(c1ccccc1)n1c(NC(=O)c2cccnc2N2CCOCC2)nc2ccccc21
InChIInChI=1S/C25H25N5O2/c1-18(19-8-3-2-4-9-19)30-22-12-6-5-11-21(22)27-25(30)28-24(31)20-10-7-13-26-23(20)29-14-16-32-17-15-29/h2-13,18H,14-17H2,1H3,(H,27,28,31)
InChIKeyDHGRHLFZPSOMQB-UHFFFAOYSA-N
XLogP4.13
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.51
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-morpholin-4-yl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
CID 84576378
N-(3-aminobutyl)-2-morpholin-4-ylpyridine-3-carboxamide
CID 119496984
N-[1-[(1S)-1-phenylethyl]benzimidazol-2-yl]thiadiazole-5-carboxamide
CID 97226668
2-morpholin-4-yl-N-naphthalen-1-ylpyridine-3-carboxamide
CID 34000334
2-morpholin-4-yl-N-[(1-propan-2-ylbenzimidazol-2-yl)methyl]benzamide
CID 86285259
N-(3-amino-4-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide
CID 119419635
N-(1-methylbenzimidazol-2-yl)-2-morpholin-4-ylpyrimidine-4-carboxamide
CID 139022042
2-morpholin-4-yl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyridine-3-carboxamide
CID 127789510
N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide
CID 95772183
N-[1-[(1R)-1-phenylethyl]benzimidazol-2-yl]-2-(tetrazol-1-yl)acetamide
CID 97226663
N-(6-methoxy-1,3-benzothiazol-2-yl)-2-morpholin-4-ylpyridine-3-carboxamide
CID 55436056
3-[(2-morpholin-4-ylpyridine-3-carbonyl)amino]propanoic acid
CID 119350991

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide?
The IUPAC name of 2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide (CID 167950597) is 2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide.
What is the SMILES notation for 2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide?
The canonical SMILES for 2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide is CC(c1ccccc1)n1c(NC(=O)c2cccnc2N2CCOCC2)nc2ccccc21.
What is the InChIKey of 2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide?
The InChIKey is DHGRHLFZPSOMQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N5O2/c1-18(19-8-3-2-4-9-19)30-22-12-6-5-11-21(22)27-25(30)28-24(31)20-10-7-13-26-23(20)29-14-16-32-17-15-29/h2-13,18H,14-17H2,1H3,(H,27,28,31).
What are the key properties of 2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide?
2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide has a molecular weight of 427.51 g/mol, XLogP of 4.13, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-N-[1-(1-phenylethyl)benzimidazol-2-yl]pyridine-3-carboxamide is sourced from PubChem (CID 167950597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).