5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide

C16H27N3O — CID 102908038

IUPAC5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)NCC(C(C)C)C(C)C)nc1
InChIInChI=1S/C16H27N3O/c1-6-17-13-7-8-15(18-9-13)16(20)19-10-14(11(2)3)12(4)5/h7-9,11-12,14,17H,6,10H2,1-5H3,(H,19,20)
InChIKeyCOSGIULXZIVMRD-UHFFFAOYSA-N
MW277.41 g/mol
LogP3.17
Rot. Bonds7

About 5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide

5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide (PubChem CID 102908038) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is 5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide
PubChem CID102908038
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC Name5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)NCC(C(C)C)C(C)C)nc1
InChIInChI=1S/C16H27N3O/c1-6-17-13-7-8-15(18-9-13)16(20)19-10-14(11(2)3)12(4)5/h7-9,11-12,14,17H,6,10H2,1-5H3,(H,19,20)
InChIKeyCOSGIULXZIVMRD-UHFFFAOYSA-N
XLogP3.17
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyrazine-2-carboxamide
CID 107377215
5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide
CID 104641912
5-(ethylamino)-N-methylpyridine-2-carboxamide
CID 104639889
5-(ethylamino)-N-hexan-2-ylpyridine-2-carboxamide
CID 113436154
5-(ethylamino)-N,N-dimethylpyridine-2-carboxamide
CID 104639848
N-[(4-bromophenyl)methyl]-5-(ethylamino)pyridine-2-carboxamide
CID 104639845
5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide
CID 113436186
5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide
CID 109181275
5-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-2-carboxamide
CID 104641394
5-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 104639698
N-(2-methylpropyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109181042
5-(ethylamino)-N-[(2-fluorophenyl)methyl]pyridine-2-carboxamide
CID 104639989

Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide?
The IUPAC name of 5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide (CID 102908038) is 5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide is CCNc1ccc(C(=O)NCC(C(C)C)C(C)C)nc1.
What is the InChIKey of 5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide?
The InChIKey is COSGIULXZIVMRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-6-17-13-7-8-15(18-9-13)16(20)19-10-14(11(2)3)12(4)5/h7-9,11-12,14,17H,6,10H2,1-5H3,(H,19,20).
What are the key properties of 5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide?
5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide has a molecular weight of 277.41 g/mol, XLogP of 3.17, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide is sourced from PubChem (CID 102908038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).