2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide

C16H20N4O — CID 82734231

IUPAC2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)NCc2ncccc2CC)ccn1
InChIInChI=1S/C16H20N4O/c1-3-12-6-5-8-18-14(12)11-20-16(21)13-7-9-19-15(10-13)17-4-2/h5-10H,3-4,11H2,1-2H3,(H,17,19)(H,20,21)
InChIKeyDLQOTFBYCMKBKY-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.40
Rot. Bonds6

About 2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide

2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide (PubChem CID 82734231) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide
PubChem CID82734231
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)NCc2ncccc2CC)ccn1
InChIInChI=1S/C16H20N4O/c1-3-12-6-5-8-18-14(12)11-20-16(21)13-7-9-19-15(10-13)17-4-2/h5-10H,3-4,11H2,1-2H3,(H,17,19)(H,20,21)
InChIKeyDLQOTFBYCMKBKY-UHFFFAOYSA-N
XLogP2.40
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(aminomethyl)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide
CID 82738139
2-(ethylamino)-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide
CID 115888757
2-(ethylamino)-N-(2-ethylphenyl)pyridine-4-carboxamide
CID 62165184
2-(ethylamino)-N-[(6-methyl-3-pyridinyl)methyl]pyridine-4-carboxamide
CID 62990051
2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide
CID 55204056
N-[(3-ethyl-2-pyridinyl)methyl]-4-(methylamino)benzamide
CID 82743343
N-[(3-ethyl-2-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide
CID 82744064
N-[(3-ethyl-2-pyridinyl)methyl]-5-hydroxypyridine-3-carboxamide
CID 82739232
N-[2-(dimethylcarbamoylamino)ethyl]-2-(ethylamino)pyridine-4-carboxamide
CID 83115069
2-(ethylamino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide
CID 62184923
2-bromo-N-[(3-ethyl-2-pyridinyl)methyl]furan-3-carboxamide
CID 106854223
3-amino-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide
CID 104742770

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide?
The IUPAC name of 2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide (CID 82734231) is 2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide is CCNc1cc(C(=O)NCc2ncccc2CC)ccn1.
What is the InChIKey of 2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide?
The InChIKey is DLQOTFBYCMKBKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-3-12-6-5-8-18-14(12)11-20-16(21)13-7-9-19-15(10-13)17-4-2/h5-10H,3-4,11H2,1-2H3,(H,17,19)(H,20,21).
What are the key properties of 2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide?
2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 2.40, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 82734231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).