6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide

C16H20N4O — CID 62240151

IUPAC6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide
SMILESCCCNc1cccc(C(=O)NCCc2cccnc2)n1
InChIInChI=1S/C16H20N4O/c1-2-9-18-15-7-3-6-14(20-15)16(21)19-11-8-13-5-4-10-17-12-13/h3-7,10,12H,2,8-9,11H2,1H3,(H,18,20)(H,19,21)
InChIKeyXVJXISBOWGJCGR-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.27
Rot. Bonds7

About 6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide

6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide (PubChem CID 62240151) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide
PubChem CID62240151
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide
SMILESCCCNc1cccc(C(=O)NCCc2cccnc2)n1
InChIInChI=1S/C16H20N4O/c1-2-9-18-15-7-3-6-14(20-15)16(21)19-11-8-13-5-4-10-17-12-13/h3-7,10,12H,2,8-9,11H2,1H3,(H,18,20)(H,19,21)
InChIKeyXVJXISBOWGJCGR-UHFFFAOYSA-N
XLogP2.27
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide
CID 117080375
N-[(3-methyl-4-pyridinyl)methyl]-6-(propylamino)pyridine-2-carboxamide
CID 114701818
1-propyl-3-(2-pyridin-3-ylethyl)urea
CID 115578203
N-[3-(1,2-benzothiazol-3-ylamino)propyl]-6-(2-pyridin-3-ylethylamino)pyridine-2-carboxamide
CID 58727179
N-[2-(5-chlorothiophen-2-yl)ethyl]-6-(propylamino)pyridine-2-carboxamide
CID 106050291
N-[2-(ethylamino)-2-oxoethyl]-6-(propylamino)pyridine-2-carboxamide
CID 55052141
N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]-6-(propylamino)pyridine-2-carboxamide
CID 63330785
N-(3-methyl-2-propan-2-ylbutyl)-6-(propylamino)pyridine-2-carboxamide
CID 102907982
N-propan-2-yl-6-(propylamino)pyridine-2-carboxamide
CID 62240109
methyl 6-(2-pyridin-3-ylethylamino)pyrazine-2-carboxylate
CID 66456102
N-(2-phenylethyl)-6-(propylamino)pyridazine-3-carboxamide
CID 62167760
2-N-[2-(dimethylamino)ethyl]-6-N-(pyridin-3-ylmethyl)pyridine-2,6-dicarboxamide
CID 109096293

Frequently Asked Questions

What is the IUPAC name of 6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide?
The IUPAC name of 6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide (CID 62240151) is 6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide?
The canonical SMILES for 6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide is CCCNc1cccc(C(=O)NCCc2cccnc2)n1.
What is the InChIKey of 6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide?
The InChIKey is XVJXISBOWGJCGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-2-9-18-15-7-3-6-14(20-15)16(21)19-11-8-13-5-4-10-17-12-13/h3-7,10,12H,2,8-9,11H2,1H3,(H,18,20)(H,19,21).
What are the key properties of 6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide?
6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 2.27, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 62240151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).