2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide

C15H24N4O — CID 47215724

IUPAC2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide
SMILESCN1CCN(c2ccc(NC(=O)C(C)(C)C)nc2)CC1
InChIInChI=1S/C15H24N4O/c1-15(2,3)14(20)17-13-6-5-12(11-16-13)19-9-7-18(4)8-10-19/h5-6,11H,7-10H2,1-4H3,(H,16,17,20)
InChIKeyCVAWIQWCCWGERR-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.82
Rot. Bonds2

About 2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide

2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide (PubChem CID 47215724) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide
PubChem CID47215724
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide
SMILESCN1CCN(c2ccc(NC(=O)C(C)(C)C)nc2)CC1
InChIInChI=1S/C15H24N4O/c1-15(2,3)14(20)17-13-6-5-12(11-16-13)19-9-7-18(4)8-10-19/h5-6,11H,7-10H2,1-4H3,(H,16,17,20)
InChIKeyCVAWIQWCCWGERR-UHFFFAOYSA-N
XLogP1.82
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-[4-(5-chloropyrimidin-2-yl)piperazin-1-yl]-2-pyridinyl]-2,2-dimethylpropanamide
CID 163356470
2,2-dimethyl-N-[5-[4-(2-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide
CID 163356186
2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide
CID 163356185
N-[5-[4-(1,3-benzoxazol-2-yl)piperazin-1-yl]-2-pyridinyl]-2,2-dimethylpropanamide
CID 163357235
2,2-dimethyl-N-[5-[4-(2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide
CID 163356599
N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]hydroxylamine
CID 142567302
N-[5-[4-(6-ethyl-5-fluoropyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]-2,2-dimethylpropanamide
CID 163356577
(1S)-2,2-dichloro-1-methyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]cyclopropane-1-carboxamide
CID 94146394
2,6-difluoro-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]benzamide
CID 86992589
N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1-oxidopyridin-1-ium-4-carboxamide
CID 60517539
N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]oxolane-3-carboxamide
CID 86850853
5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine
CID 90810476

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide (CID 47215724) is 2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide is CN1CCN(c2ccc(NC(=O)C(C)(C)C)nc2)CC1.
What is the InChIKey of 2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide?
The InChIKey is CVAWIQWCCWGERR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-15(2,3)14(20)17-13-6-5-12(11-16-13)19-9-7-18(4)8-10-19/h5-6,11H,7-10H2,1-4H3,(H,16,17,20).
What are the key properties of 2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide?
2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide has a molecular weight of 276.38 g/mol, XLogP of 1.82, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide is sourced from PubChem (CID 47215724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).