4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide

C19H24N4O — CID 136520406

IUPAC4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide
SMILESCCc1ccnc(C(=O)NCC2CCN(c3ccncc3)CC2)c1
InChIInChI=1S/C19H24N4O/c1-2-15-3-10-21-18(13-15)19(24)22-14-16-6-11-23(12-7-16)17-4-8-20-9-5-17/h3-5,8-10,13,16H,2,6-7,11-12,14H2,1H3,(H,22,24)
InChIKeyKXYDEKZJRXFFFU-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.69
Rot. Bonds5

About 4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide

4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide (PubChem CID 136520406) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is 4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide
PubChem CID136520406
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide
SMILESCCc1ccnc(C(=O)NCC2CCN(c3ccncc3)CC2)c1
InChIInChI=1S/C19H24N4O/c1-2-15-3-10-21-18(13-15)19(24)22-14-16-6-11-23(12-7-16)17-4-8-20-9-5-17/h3-5,8-10,13,16H,2,6-7,11-12,14H2,1H3,(H,22,24)
InChIKeyKXYDEKZJRXFFFU-UHFFFAOYSA-N
XLogP2.69
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-diethoxy-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]benzamide
CID 121108808
N-[[1-(2-methyl-4-pyridinyl)piperidin-4-yl]methyl]pyrazine-2-carboxamide
CID 131927095
N'-[(1-pyridin-4-ylpiperidin-4-yl)methyl]oxamide
CID 86263499
2-(3-methylphenyl)-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]acetamide
CID 86263544
N'-cycloheptyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]oxamide
CID 121107666
4-fluoro-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]benzamide
CID 121108725
methyl 4-[4-(methylaminomethyl)piperidin-1-yl]pyridine-2-carboxylate
CID 66287702
N'-propan-2-yl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]oxamide
CID 121107650
tert-butyl N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]carbamate
CID 20801237
[1-(2-methyl-4-pyridinyl)piperidin-4-yl]methylcarbamic acid
CID 22052415
1-(3,4-dimethylphenyl)-3-[(1-pyridin-4-ylpiperidin-4-yl)methyl]urea
CID 86263595
3-cyano-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]benzamide
CID 121108732

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide?
The IUPAC name of 4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide (CID 136520406) is 4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide is CCc1ccnc(C(=O)NCC2CCN(c3ccncc3)CC2)c1.
What is the InChIKey of 4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide?
The InChIKey is KXYDEKZJRXFFFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-2-15-3-10-21-18(13-15)19(24)22-14-16-6-11-23(12-7-16)17-4-8-20-9-5-17/h3-5,8-10,13,16H,2,6-7,11-12,14H2,1H3,(H,22,24).
What are the key properties of 4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide?
4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide has a molecular weight of 324.43 g/mol, XLogP of 2.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 136520406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).