N-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide

C18H26N4O3 — CID 71878322

IUPACN-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide
SMILESCN(C)c1ccc(NC(=O)C2CCCCN2C(=O)C2CCCO2)nc1
InChIInChI=1S/C18H26N4O3/c1-21(2)13-8-9-16(19-12-13)20-17(23)14-6-3-4-10-22(14)18(24)15-7-5-11-25-15/h8-9,12,14-15H,3-7,10-11H2,1-2H3,(H,19,20,23)
InChIKeyYTYJNLICTJEHMY-UHFFFAOYSA-N
MW346.43 g/mol
LogP1.65
Rot. Bonds4

About N-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide

N-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide (PubChem CID 71878322) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide
PubChem CID71878322
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC NameN-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide
SMILESCN(C)c1ccc(NC(=O)C2CCCCN2C(=O)C2CCCO2)nc1
InChIInChI=1S/C18H26N4O3/c1-21(2)13-8-9-16(19-12-13)20-17(23)14-6-3-4-10-22(14)18(24)15-7-5-11-25-15/h8-9,12,14-15H,3-7,10-11H2,1-2H3,(H,19,20,23)
InChIKeyYTYJNLICTJEHMY-UHFFFAOYSA-N
XLogP1.65
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-acetyl-N-[5-(dimethylamino)-2-pyridinyl]piperidine-2-carboxamide
CID 167862943
(2R)-1-(3,5-dichlorobenzoyl)-N-[5-(dimethylamino)-2-pyridinyl]pyrrolidine-2-carboxamide
CID 52532720
N-[5-(dimethylamino)-2-pyridinyl]-2-methyloxane-3-carboxamide
CID 129000728
(2S,3S)-N-[5-(dimethylamino)-2-pyridinyl]-2-methyloxane-3-carboxamide
CID 129400783
N-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide
CID 113030509
(2R)-N-[5-(dimethylamino)-2-pyridinyl]-1-(1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
CID 95620247
N-(5-bromo-2-pyridinyl)-1-(oxolane-2-carbonyl)piperidine-4-carboxamide
CID 55932163
(2S)-N-methyl-1-[(2R)-oxolane-2-carbonyl]-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide
CID 124546406
(2S)-N-methyl-1-[(2S)-oxolane-2-carbonyl]-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide
CID 124546404
N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide
CID 113030195
(2S)-1-(oxolane-2-carbonyl)-N-[4-[2-[4-[[(2S)-1-(oxolane-2-carbonyl)pyrrolidine-2-carbonyl]amino]phenyl]-1,3-oxazol-5-yl]phenyl]pyrrolidine-2-carboxamide
CID 67313325
N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide
CID 113030095

Frequently Asked Questions

What is the IUPAC name of N-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide?
The IUPAC name of N-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide (CID 71878322) is N-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide.
What is the SMILES notation for N-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide?
The canonical SMILES for N-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide is CN(C)c1ccc(NC(=O)C2CCCCN2C(=O)C2CCCO2)nc1.
What is the InChIKey of N-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide?
The InChIKey is YTYJNLICTJEHMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O3/c1-21(2)13-8-9-16(19-12-13)20-17(23)14-6-3-4-10-22(14)18(24)15-7-5-11-25-15/h8-9,12,14-15H,3-7,10-11H2,1-2H3,(H,19,20,23).
What are the key properties of N-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide?
N-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide has a molecular weight of 346.43 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide is sourced from PubChem (CID 71878322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).