N-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide

C17H25N3O2 — CID 113024751

IUPACN-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide
SMILESO=C(Nc1ccc(NC2CCCCC2)cn1)C1CCOCC1
InChIInChI=1S/C17H25N3O2/c21-17(13-8-10-22-11-9-13)20-16-7-6-15(12-18-16)19-14-4-2-1-3-5-14/h6-7,12-14,19H,1-5,8-11H2,(H,18,20,21)
InChIKeyLAYMIBUDYULYKW-UHFFFAOYSA-N
MW303.41 g/mol
LogP3.19
Rot. Bonds4

About N-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide

N-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide (PubChem CID 113024751) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is N-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide.

Molecular Properties

Compound NameN-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide
PubChem CID113024751
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC NameN-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide
SMILESO=C(Nc1ccc(NC2CCCCC2)cn1)C1CCOCC1
InChIInChI=1S/C17H25N3O2/c21-17(13-8-10-22-11-9-13)20-16-7-6-15(12-18-16)19-14-4-2-1-3-5-14/h6-7,12-14,19H,1-5,8-11H2,(H,18,20,21)
InChIKeyLAYMIBUDYULYKW-UHFFFAOYSA-N
XLogP3.19
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(cyclopropylamino)-2-pyridinyl]cyclopropanecarboxamide
CID 113023685
N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide
CID 113030095
N-[6-(cyclopentylamino)-3-pyridinyl]cyclohexanecarboxamide
CID 113009854
N-[5-(4-acetylanilino)-2-pyridinyl]oxane-4-carboxamide
CID 113035088
methyl N-[5-(cyclopentylamino)-2-pyridinyl]carbamate
CID 113024495
N-[6-(2,6-dimethylanilino)-3-pyridinyl]oxane-4-carboxamide
CID 113017207
1-[5-(cyclohexylamino)-2-pyridinyl]-3-propan-2-ylurea
CID 113024752
4-[[5-(cyclohexylamino)-2-pyridinyl]amino]-4-oxobutanoic acid
CID 39187428
N-[4-(cyclooctylamino)phenyl]cyclopropanecarboxamide
CID 29049901
ethyl 4-[[5-(oxane-4-carbonylamino)-2-pyridinyl]amino]piperidine-1-carboxylate
CID 113014202
N-[5-(cyclohexylamino)-2-pyridinyl]-4-methylbenzamide
CID 113024697
4-amino-N-[5-(cyclooctylamino)-2-pyridinyl]butanamide
CID 82034210

Frequently Asked Questions

What is the IUPAC name of N-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide?
The IUPAC name of N-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide (CID 113024751) is N-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide.
What is the SMILES notation for N-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide?
The canonical SMILES for N-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide is O=C(Nc1ccc(NC2CCCCC2)cn1)C1CCOCC1.
What is the InChIKey of N-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide?
The InChIKey is LAYMIBUDYULYKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2/c21-17(13-8-10-22-11-9-13)20-16-7-6-15(12-18-16)19-14-4-2-1-3-5-14/h6-7,12-14,19H,1-5,8-11H2,(H,18,20,21).
What are the key properties of N-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide?
N-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide has a molecular weight of 303.41 g/mol, XLogP of 3.19, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide is sourced from PubChem (CID 113024751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).