N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide

C17H25N3O2 — CID 113030095

IUPACN-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide
SMILESO=C(Nc1ccc(NC2CCCCCC2)cn1)C1CCCO1
InChIInChI=1S/C17H25N3O2/c21-17(15-8-5-11-22-15)20-16-10-9-14(12-18-16)19-13-6-3-1-2-4-7-13/h9-10,12-13,15,19H,1-8,11H2,(H,18,20,21)
InChIKeyTYGUFKZGPAMXQB-UHFFFAOYSA-N
MW303.41 g/mol
LogP3.33
Rot. Bonds4

About N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide

N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide (PubChem CID 113030095) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide
PubChem CID113030095
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC NameN-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide
SMILESO=C(Nc1ccc(NC2CCCCCC2)cn1)C1CCCO1
InChIInChI=1S/C17H25N3O2/c21-17(15-8-5-11-22-15)20-16-10-9-14(12-18-16)19-13-6-3-1-2-4-7-13/h9-10,12-13,15,19H,1-8,11H2,(H,18,20,21)
InChIKeyTYGUFKZGPAMXQB-UHFFFAOYSA-N
XLogP3.33
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 ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(cyclohexylamino)-2-pyridinyl]oxane-4-carboxamide
CID 113024751
(2S)-N-(5-iodo-2-pyridinyl)oxolane-2-carboxamide
CID 103873257
(2S)-N-(5-bromo-2-pyridinyl)oxolane-2-carboxamide
CID 7346608
N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide
CID 115268574
N-[6-(cyclopentylamino)-3-pyridinyl]cyclohexanecarboxamide
CID 113009854
N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide
CID 113028252
N-[5-(4-pyrrolidin-1-ylanilino)-2-pyridinyl]oxolane-2-carboxamide
CID 113035628
N-[5-(cyclopropylamino)-2-pyridinyl]cyclopropanecarboxamide
CID 113023685
N-[5-[3-(dimethylamino)propylamino]-2-pyridinyl]oxolane-2-carboxamide
CID 113025707
N-[5-(2,3-dimethylanilino)-2-pyridinyl]oxolane-2-carboxamide
CID 113032322
N-[5-(2,4-dimethylanilino)-2-pyridinyl]oxolane-2-carboxamide
CID 113031947
N-[6-(2,6-difluoroanilino)-3-pyridinyl]oxolane-2-carboxamide
CID 113023110

Frequently Asked Questions

What is the IUPAC name of N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide?
The IUPAC name of N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide (CID 113030095) is N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide?
The canonical SMILES for N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide is O=C(Nc1ccc(NC2CCCCCC2)cn1)C1CCCO1.
What is the InChIKey of N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide?
The InChIKey is TYGUFKZGPAMXQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2/c21-17(15-8-5-11-22-15)20-16-10-9-14(12-18-16)19-13-6-3-1-2-4-7-13/h9-10,12-13,15,19H,1-8,11H2,(H,18,20,21).
What are the key properties of N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide?
N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide has a molecular weight of 303.41 g/mol, XLogP of 3.33, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide is sourced from PubChem (CID 113030095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).