N-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide

C18H26N4O3 — CID 127885756

IUPACN-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide
SMILESCOc1ccc(N(C)C(=O)C2CCCN(C(=O)N3CCCC3)C2)nc1
InChIInChI=1S/C18H26N4O3/c1-20(16-8-7-15(25-2)12-19-16)17(23)14-6-5-11-22(13-14)18(24)21-9-3-4-10-21/h7-8,12,14H,3-6,9-11,13H2,1-2H3
InChIKeyZIPSVQLGARRPLB-UHFFFAOYSA-N
MW346.43 g/mol
LogP1.98
Rot. Bonds3

About N-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide

N-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide (PubChem CID 127885756) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide
PubChem CID127885756
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC NameN-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide
SMILESCOc1ccc(N(C)C(=O)C2CCCN(C(=O)N3CCCC3)C2)nc1
InChIInChI=1S/C18H26N4O3/c1-20(16-8-7-15(25-2)12-19-16)17(23)14-6-5-11-22(13-14)18(24)21-9-3-4-10-21/h7-8,12,14H,3-6,9-11,13H2,1-2H3
InChIKeyZIPSVQLGARRPLB-UHFFFAOYSA-N
XLogP1.98
TPSA65.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-1-[(4-methoxyphenyl)-methylcarbamoyl]piperidine-3-carboxylic acid
CID 81120360
N-(5-bromo-2-pyridinyl)-N-methylcyclohexanecarboxamide
CID 115268285
N-(5-methoxy-2-pyridinyl)-N,1-dimethylcyclopropane-1-carboxamide
CID 166216775
methyl 3-(4-methoxybenzoyl)piperidine-1-carboxylate
CID 110394724
cyclopentyl-[3-(4-methoxybenzoyl)piperidin-1-yl]methanone
CID 110394678
methyl 1-(azepane-1-carbonyl)piperidine-3-carboxylate
CID 113330700
1-[(4-chlorophenyl)methyl]-N-(4-methoxyphenyl)-N-methylpiperidine-3-carboxamide
CID 133159211
(3R)-1-[(4-chlorophenyl)methyl]-N-(4-methoxyphenyl)-N-methylpiperidine-3-carboxamide
CID 100777734
(3S)-1-[6-(dimethylamino)pyridine-3-carbonyl]piperidine-3-carboxylic acid
CID 81120843
N-[(4-methoxyphenyl)methyl]-N,1-dimethylpiperidine-3-carboxamide
CID 132649734
(3S)-1-cyano-N-methyl-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide
CID 130345313
cyclohexyl-[3-(4-methoxyphenyl)azepan-1-yl]methanone
CID 121146925

Frequently Asked Questions

What is the IUPAC name of N-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide?
The IUPAC name of N-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide (CID 127885756) is N-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for N-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide is COc1ccc(N(C)C(=O)C2CCCN(C(=O)N3CCCC3)C2)nc1.
What is the InChIKey of N-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide?
The InChIKey is ZIPSVQLGARRPLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O3/c1-20(16-8-7-15(25-2)12-19-16)17(23)14-6-5-11-22(13-14)18(24)21-9-3-4-10-21/h7-8,12,14H,3-6,9-11,13H2,1-2H3.
What are the key properties of N-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide?
N-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide has a molecular weight of 346.43 g/mol, XLogP of 1.98, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methoxy-2-pyridinyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 127885756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).