4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide

C11H16N4O — CID 3370606

IUPAC4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide
SMILESCN1CCN(C(=O)Nc2cccnc2)CC1
InChIInChI=1S/C11H16N4O/c1-14-5-7-15(8-6-14)11(16)13-10-3-2-4-12-9-10/h2-4,9H,5-8H2,1H3,(H,13,16)
InChIKeySEMZSKCYJBRHBY-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.86
Rot. Bonds1

About 4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide

4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide (PubChem CID 3370606) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide
PubChem CID3370606
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide
SMILESCN1CCN(C(=O)Nc2cccnc2)CC1
InChIInChI=1S/C11H16N4O/c1-14-5-7-15(8-6-14)11(16)13-10-3-2-4-12-9-10/h2-4,9H,5-8H2,1H3,(H,13,16)
InChIKeySEMZSKCYJBRHBY-UHFFFAOYSA-N
XLogP0.86
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-formyl-N-pyridin-3-ylpiperazine-1-carboxamide
CID 110706402
4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide
CID 18101774
1-methylpyrrolidine;pyridin-3-ylurea
CID 143564599
4-(bromomethylidene)-N-pyridin-3-ylpiperidine-1-carboxamide
CID 66883942
1-methyl-N-pyridin-3-yl-4,6-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide
CID 146144583
1-[4-(4-methylpiperazin-1-yl)phenyl]-3-pyridin-3-ylurea
CID 48759640
4-(1-methyl-5-phenylpyrazole-3-carbonyl)-N-pyridin-3-ylpiperazine-1-carboxamide
CID 164898189
(3S)-4-methyl-3-(1-methylimidazol-2-yl)-N-pyridin-3-ylpiperazine-1-carboxamide
CID 129472974
4-[cyclobutyl(methylsulfonyl)amino]-N-pyridin-3-ylazepane-1-carboxamide
CID 129004395
4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylpiperazine-1-carboxamide
CID 138674290
N-[4-(4-methylpiperazine-1-carbonyl)phenyl]pyridine-3-carboxamide
CID 94646302
N-phenyl-4-pyridin-3-yl-1,4-diazepane-1-carboxamide
CID 118068179

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide?
The IUPAC name of 4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide (CID 3370606) is 4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide.
What is the SMILES notation for 4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide?
The canonical SMILES for 4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide is CN1CCN(C(=O)Nc2cccnc2)CC1.
What is the InChIKey of 4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide?
The InChIKey is SEMZSKCYJBRHBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-14-5-7-15(8-6-14)11(16)13-10-3-2-4-12-9-10/h2-4,9H,5-8H2,1H3,(H,13,16).
What are the key properties of 4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide?
4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide has a molecular weight of 220.28 g/mol, XLogP of 0.86, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide is sourced from PubChem (CID 3370606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).