5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide

C13H21N5O — CID 81316862

IUPAC5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide
SMILESCN1CCN(CCNC(=O)c2ccc(N)cn2)CC1
InChIInChI=1S/C13H21N5O/c1-17-6-8-18(9-7-17)5-4-15-13(19)12-3-2-11(14)10-16-12/h2-3,10H,4-9,14H2,1H3,(H,15,19)
InChIKeyOLUCEQNTIFBADL-UHFFFAOYSA-N
MW263.34 g/mol
LogP-0.36
Rot. Bonds4

About 5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide

5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide (PubChem CID 81316862) has the molecular formula C13H21N5O and a molecular weight of 263.34 g/mol. Its IUPAC name is 5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide
PubChem CID81316862
Molecular FormulaC13H21N5O
Molecular Weight263.34 g/mol
Exact Mass263.17
IUPAC Name5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide
SMILESCN1CCN(CCNC(=O)c2ccc(N)cn2)CC1
InChIInChI=1S/C13H21N5O/c1-17-6-8-18(9-7-17)5-4-15-13(19)12-3-2-11(14)10-16-12/h2-3,10H,4-9,14H2,1H3,(H,15,19)
InChIKeyOLUCEQNTIFBADL-UHFFFAOYSA-N
XLogP-0.36
TPSA74.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-N-[2-(4-methylpiperazin-1-yl)ethyl]pyrazine-2-carboxamide
CID 107371808
5-amino-N-[(1-methylpiperidin-4-yl)methyl]pyridine-2-carboxamide
CID 81316570
5-(aminomethyl)-N-(2-piperidin-1-ylethyl)pyridine-2-carboxamide
CID 63724906
3-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]benzamide
CID 54861059
5-amino-N-(5-hydroxypentyl)pyridine-2-carboxamide
CID 107316260
4-chloro-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-3-carboxamide
CID 81225983
3-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]-1H-pyrazole-5-carboxamide
CID 64523251
5-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyridine-2-carboxamide
CID 81319681
4-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]-2-(trifluoromethyl)benzamide
CID 170994837
5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide
CID 106327192
5-amino-N-prop-2-ynylpyridine-2-carboxamide
CID 81316148
2-(aminomethyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-4-carboxamide
CID 114325905

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide (CID 81316862) is 5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide is CN1CCN(CCNC(=O)c2ccc(N)cn2)CC1.
What is the InChIKey of 5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide?
The InChIKey is OLUCEQNTIFBADL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O/c1-17-6-8-18(9-7-17)5-4-15-13(19)12-3-2-11(14)10-16-12/h2-3,10H,4-9,14H2,1H3,(H,15,19).
What are the key properties of 5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide?
5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide has a molecular weight of 263.34 g/mol, XLogP of -0.36, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 81316862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).