N-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide

C20H26N2O — CID 135058789

IUPACN-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide
SMILESCCCc1cccc(CCC)c1C(C)NC(=O)c1ccccn1
InChIInChI=1S/C20H26N2O/c1-4-9-16-11-8-12-17(10-5-2)19(16)15(3)22-20(23)18-13-6-7-14-21-18/h6-8,11-15H,4-5,9-10H2,1-3H3,(H,22,23)
InChIKeyOHQKTWXHRSUZQE-UHFFFAOYSA-N
MW310.44 g/mol
LogP4.48
Rot. Bonds7

About N-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide

N-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide (PubChem CID 135058789) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is N-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide
PubChem CID135058789
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC NameN-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide
SMILESCCCc1cccc(CCC)c1C(C)NC(=O)c1ccccn1
InChIInChI=1S/C20H26N2O/c1-4-9-16-11-8-12-17(10-5-2)19(16)15(3)22-20(23)18-13-6-7-14-21-18/h6-8,11-15H,4-5,9-10H2,1-3H3,(H,22,23)
InChIKeyOHQKTWXHRSUZQE-UHFFFAOYSA-N
XLogP4.48
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-[2,6-bis(2-phenylethyl)phenyl]ethyl]pyridine-2-carboxamide
CID 72711534
N-[1-[2,6-bis(2-methylpropyl)phenyl]ethyl]pyridine-2-carboxamide
CID 72711320
N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-2-carboxamide
CID 103722949
N-(2,6-diethylphenyl)pyridine-2-carboxamide
CID 19224278
N-[(1S)-1-(3-chlorophenyl)ethyl]pyridine-2-carboxamide
CID 26907997
N-[(1R)-1-(3-chlorophenyl)ethyl]pyridine-2-carboxamide
CID 26907996
N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide
CID 43392707
(2R,3S)-3-methyl-2-(pyridine-2-carbonylamino)pentanoic acid
CID 30054092
(2R,3R)-3-methyl-2-(pyridine-2-carbonylamino)pentanoic acid
CID 30054086
N-(1-phenylpropyl)pyridine-2-carboxamide
CID 5305559
N-(1-bromobutan-2-yl)pyridine-2-carboxamide
CID 114307782
ethyl 3-hydroxy-2-(pyridine-2-carbonylamino)propanoate
CID 70817337

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide?
The IUPAC name of N-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide (CID 135058789) is N-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for N-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide is CCCc1cccc(CCC)c1C(C)NC(=O)c1ccccn1.
What is the InChIKey of N-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide?
The InChIKey is OHQKTWXHRSUZQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O/c1-4-9-16-11-8-12-17(10-5-2)19(16)15(3)22-20(23)18-13-6-7-14-21-18/h6-8,11-15H,4-5,9-10H2,1-3H3,(H,22,23).
What are the key properties of N-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide?
N-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide has a molecular weight of 310.44 g/mol, XLogP of 4.48, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,6-dipropylphenyl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 135058789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).