N-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide

C19H25N5O3 — CID 109185331

IUPACN-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide
SMILESCN(C)CCNC(=O)c1ccc(N2CCN(C(=O)c3ccco3)CC2)cn1
InChIInChI=1S/C19H25N5O3/c1-22(2)8-7-20-18(25)16-6-5-15(14-21-16)23-9-11-24(12-10-23)19(26)17-4-3-13-27-17/h3-6,13-14H,7-12H2,1-2H3,(H,20,25)
InChIKeyGCDFUQBUWWYRTC-UHFFFAOYSA-N
MW371.44 g/mol
LogP0.93
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide

N-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide (PubChem CID 109185331) has the molecular formula C19H25N5O3 and a molecular weight of 371.44 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide
PubChem CID109185331
Molecular FormulaC19H25N5O3
Molecular Weight371.44 g/mol
Exact Mass371.20
IUPAC NameN-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide
SMILESCN(C)CCNC(=O)c1ccc(N2CCN(C(=O)c3ccco3)CC2)cn1
InChIInChI=1S/C19H25N5O3/c1-22(2)8-7-20-18(25)16-6-5-15(14-21-16)23-9-11-24(12-10-23)19(26)17-4-3-13-27-17/h3-6,13-14H,7-12H2,1-2H3,(H,20,25)
InChIKeyGCDFUQBUWWYRTC-UHFFFAOYSA-N
XLogP0.93
TPSA81.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[5-[3-(dimethylamino)propylamino]-2-pyridinyl]-[4-(furan-2-carbonyl)piperazin-1-yl]methanone
CID 109186130
N-[2-(dimethylamino)ethyl]-2-[4-(furan-2-carbonyl)piperazin-1-yl]acetamide
CID 108994620
N-[3-(dimethylamino)propyl]-5-piperidin-1-ylpyridine-2-carboxamide
CID 109182724
N-[2-(dimethylamino)ethyl]-5-(4-pyrrolidin-1-ylanilino)pyridine-2-carboxamide
CID 109185416
N-butyl-4-[4-(furan-2-carbonyl)piperazin-1-yl]-N-methylpyridine-2-carboxamide
CID 109216191
5-(4-acetylpiperazin-1-yl)-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 109183834
ethyl 4-[6-(2-phenylethylcarbamoyl)-3-pyridinyl]piperazine-1-carboxylate
CID 109191756
N-butyl-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-3-carboxamide
CID 109224407
[4-[2-[2-(dimethylamino)ethylamino]-6-methylpyrimidin-4-yl]piperazin-1-yl]-(furan-2-yl)methanone
CID 112912995
N-butyl-5-[4-(furan-2-carbonyl)piperazin-1-yl]-N-methylpyrazine-2-carboxamide
CID 109286550
N-[3-(dimethylamino)propyl]-1-[4-(furan-2-carbonyl)piperazine-1-carbonyl]cyclopropane-1-carboxamide
CID 108973773
[4-[2-(diethylamino)pyrimidine-5-carbonyl]piperazin-1-yl]-(furan-2-yl)methanone
CID 109262135

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide (CID 109185331) is N-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide is CN(C)CCNC(=O)c1ccc(N2CCN(C(=O)c3ccco3)CC2)cn1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide?
The InChIKey is GCDFUQBUWWYRTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O3/c1-22(2)8-7-20-18(25)16-6-5-15(14-21-16)23-9-11-24(12-10-23)19(26)17-4-3-13-27-17/h3-6,13-14H,7-12H2,1-2H3,(H,20,25).
What are the key properties of N-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide?
N-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide has a molecular weight of 371.44 g/mol, XLogP of 0.93, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-5-[4-(furan-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide is sourced from PubChem (CID 109185331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).