N-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide

C20H23N3O2 — CID 99831743

IUPACN-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide
SMILESO=C(NC1(Cc2ccccc2)CC1)c1cc(N2CCOCC2)ccn1
InChIInChI=1S/C20H23N3O2/c24-19(22-20(7-8-20)15-16-4-2-1-3-5-16)18-14-17(6-9-21-18)23-10-12-25-13-11-23/h1-6,9,14H,7-8,10-13,15H2,(H,22,24)
InChIKeyGYFVAMGLGFEGBI-UHFFFAOYSA-N
MW337.42 g/mol
LogP2.42
Rot. Bonds5

About N-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide

N-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide (PubChem CID 99831743) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide
PubChem CID99831743
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide
SMILESO=C(NC1(Cc2ccccc2)CC1)c1cc(N2CCOCC2)ccn1
InChIInChI=1S/C20H23N3O2/c24-19(22-20(7-8-20)15-16-4-2-1-3-5-16)18-14-17(6-9-21-18)23-10-12-25-13-11-23/h1-6,9,14H,7-8,10-13,15H2,(H,22,24)
InChIKeyGYFVAMGLGFEGBI-UHFFFAOYSA-N
XLogP2.42
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-benzylcyclopropyl)-4-(2,6-dimethylmorpholin-4-yl)pyridine-2-carboxamide
CID 162682804
4-morpholin-4-yl-N-(2-phenylethyl)pyridine-2-carboxamide
CID 109206585
N-(1-benzylcyclopropyl)-4-chloropyridine-2-carboxamide
CID 170994125
N-[1-[(3,5-difluoro-2-methoxyphenyl)methyl]cyclopropyl]-4-morpholin-4-ylpyridine-2-carboxamide
CID 162682953
N-benzyl-N-hydroxy-4-morpholin-4-ylpyridine-2-carboxamide
CID 86681827
N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide
CID 109202858
N-[(3-chlorophenyl)methyl]-4-morpholin-4-ylpyridine-2-carboxamide
CID 9401810
N-[(4S)-4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-4-morpholin-4-ylpyridine-2-carboxamide
CID 31482332
N-[1-[(3-fluorophenyl)methyl]cyclopropyl]-4-[(3S)-3-hydroxypiperidin-1-yl]pyridine-2-carboxamide
CID 162682695
N-[1-[(2-fluorophenyl)methyl]cyclopropyl]-4-[(3S)-3-hydroxypyrrolidin-1-yl]pyridine-2-carboxamide
CID 162682814
N-(1-benzylcyclohexyl)pyrazine-2-carboxamide
CID 110661541
(E)-2-(4-morpholin-4-yl-2-pyridinyl)-2-phenylmethoxyethenamine
CID 164560022

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide?
The IUPAC name of N-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide (CID 99831743) is N-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide.
What is the SMILES notation for N-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide?
The canonical SMILES for N-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide is O=C(NC1(Cc2ccccc2)CC1)c1cc(N2CCOCC2)ccn1.
What is the InChIKey of N-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide?
The InChIKey is GYFVAMGLGFEGBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c24-19(22-20(7-8-20)15-16-4-2-1-3-5-16)18-14-17(6-9-21-18)23-10-12-25-13-11-23/h1-6,9,14H,7-8,10-13,15H2,(H,22,24).
What are the key properties of N-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide?
N-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide has a molecular weight of 337.42 g/mol, XLogP of 2.42, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylcyclopropyl)-4-morpholin-4-ylpyridine-2-carboxamide is sourced from PubChem (CID 99831743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).