N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide

C11H16N4O — CID 110466807

IUPACN-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide
SMILESCN1CCC(NC(=O)c2cncnc2)CC1
InChIInChI=1S/C11H16N4O/c1-15-4-2-10(3-5-15)14-11(16)9-6-12-8-13-7-9/h6-8,10H,2-5H2,1H3,(H,14,16)
InChIKeyOEPALOBAUMTDTF-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.30
Rot. Bonds2

About N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide

N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide (PubChem CID 110466807) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide
PubChem CID110466807
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC NameN-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide
SMILESCN1CCC(NC(=O)c2cncnc2)CC1
InChIInChI=1S/C11H16N4O/c1-15-4-2-10(3-5-15)14-11(16)9-6-12-8-13-7-9/h6-8,10H,2-5H2,1H3,(H,14,16)
InChIKeyOEPALOBAUMTDTF-UHFFFAOYSA-N
XLogP0.30
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethenyl-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide
CID 155919871
ethane;N-(1-methylpiperidin-4-yl)benzamide
CID 142009687
N-(1-methylpiperidin-4-yl)furo[2,3-d]pyrimidine-5-carboxamide
CID 175950998
3,5-diamino-N-(1-methylpiperidin-4-yl)benzamide
CID 61094399
4-amino-3-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 43373277
[4-[(1-methylpiperidin-4-yl)carbamoyl]phenyl]boronic acid
CID 140843225
4-carbamothioyl-N-(1-methylpiperidin-4-yl)benzamide
CID 43373646
4-acetamido-N-(1-methylpiperidin-4-yl)benzamide
CID 47114509
4-bromo-3-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 54252935
N-cycloheptyl-5-(4-methylpiperazine-1-carbonyl)pyridine-3-carboxamide
CID 109104440
N-(1-methylpiperidin-4-yl)-1H-1,2,4-triazole-5-carboxamide
CID 67184534
N-(1,4-dioxaspiro[4.5]decan-8-yl)pyrimidine-5-carboxamide
CID 104626056

Frequently Asked Questions

What is the IUPAC name of N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide?
The IUPAC name of N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide (CID 110466807) is N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide.
What is the SMILES notation for N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide?
The canonical SMILES for N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide is CN1CCC(NC(=O)c2cncnc2)CC1.
What is the InChIKey of N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide?
The InChIKey is OEPALOBAUMTDTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-15-4-2-10(3-5-15)14-11(16)9-6-12-8-13-7-9/h6-8,10H,2-5H2,1H3,(H,14,16).
What are the key properties of N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide?
N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide has a molecular weight of 220.28 g/mol, XLogP of 0.30, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide is sourced from PubChem (CID 110466807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).