1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide

C15H24N4O — CID 79245258

IUPAC1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide
SMILESCCNc1ccnc(CN2CCC(C(=O)NC)CC2)c1
InChIInChI=1S/C15H24N4O/c1-3-17-13-4-7-18-14(10-13)11-19-8-5-12(6-9-19)15(20)16-2/h4,7,10,12H,3,5-6,8-9,11H2,1-2H3,(H,16,20)(H,17,18)
InChIKeyDJUYYWBZRPQTCS-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.47
Rot. Bonds5

About 1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide

1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide (PubChem CID 79245258) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide
PubChem CID79245258
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide
SMILESCCNc1ccnc(CN2CCC(C(=O)NC)CC2)c1
InChIInChI=1S/C15H24N4O/c1-3-17-13-4-7-18-14(10-13)11-19-8-5-12(6-9-19)15(20)16-2/h4,7,10,12H,3,5-6,8-9,11H2,1-2H3,(H,16,20)(H,17,18)
InChIKeyDJUYYWBZRPQTCS-UHFFFAOYSA-N
XLogP1.47
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 1-[[4-(ethylamino)-2-pyridinyl]methyl]piperidine-4-carboxylate
CID 79245074
N-ethyl-2-[(3-methylpyrrolidin-1-yl)methyl]pyridin-4-amine
CID 79245667
N-ethyl-2-[(3-propylpyrrolidin-1-yl)methyl]pyridin-4-amine
CID 112549006
N-ethyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]pyridin-4-amine
CID 79251269
2-[(4,4-dimethylazepan-1-yl)methyl]-N-ethylpyridin-4-amine
CID 79251280
2-[1-[[4-(methylamino)-2-pyridinyl]methyl]piperidin-4-yl]acetamide
CID 79245038
N-ethyl-2-[(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)methyl]pyridin-4-amine
CID 81200136
N-methyl-1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidine-4-carboxamide
CID 103056085
1-[[4-(ethylamino)-2-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide
CID 79245243
2-(azepan-1-ylmethyl)-N-methylpyridin-4-amine
CID 79245088
N-methyl-1-[[6-(methylamino)-3-pyridinyl]methyl]piperidine-4-carboxamide
CID 55046042
1-[(6-chloro-2-pyridinyl)methyl]-N-methylpiperidine-4-carboxamide
CID 79039473

Frequently Asked Questions

What is the IUPAC name of 1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide?
The IUPAC name of 1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide (CID 79245258) is 1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide?
The canonical SMILES for 1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide is CCNc1ccnc(CN2CCC(C(=O)NC)CC2)c1.
What is the InChIKey of 1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide?
The InChIKey is DJUYYWBZRPQTCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-3-17-13-4-7-18-14(10-13)11-19-8-5-12(6-9-19)15(20)16-2/h4,7,10,12H,3,5-6,8-9,11H2,1-2H3,(H,16,20)(H,17,18).
What are the key properties of 1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide?
1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-(ethylamino)-2-pyridinyl]methyl]-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 79245258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).