N-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide

C13H20N4O2 — CID 122260053

IUPACN-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide
SMILESCCCNC(=O)N1CCCC(Oc2ccncn2)C1
InChIInChI=1S/C13H20N4O2/c1-2-6-15-13(18)17-8-3-4-11(9-17)19-12-5-7-14-10-16-12/h5,7,10-11H,2-4,6,8-9H2,1H3,(H,15,18)
InChIKeyMIYLAESHUJCBCD-UHFFFAOYSA-N
MW264.33 g/mol
LogP1.44
Rot. Bonds4

About N-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide

N-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide (PubChem CID 122260053) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide.

Molecular Properties

Compound NameN-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide
PubChem CID122260053
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC NameN-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide
SMILESCCCNC(=O)N1CCCC(Oc2ccncn2)C1
InChIInChI=1S/C13H20N4O2/c1-2-6-15-13(18)17-8-3-4-11(9-17)19-12-5-7-14-10-16-12/h5,7,10-11H,2-4,6,8-9H2,1H3,(H,15,18)
InChIKeyMIYLAESHUJCBCD-UHFFFAOYSA-N
XLogP1.44
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide
CID 122260044
N-(2-methoxyethyl)-3-pyrimidin-4-yloxypiperidine-1-carboxamide
CID 122260046
N-(2-phenylethyl)-3-pyrimidin-4-yloxypiperidine-1-carboxamide
CID 122161080
3-chloro-2,2-dimethyl-1-(3-pyrimidin-4-yloxypiperidin-1-yl)propan-1-one
CID 122259763
2-cyclohexyl-1-(3-pyrimidin-4-yloxypiperidin-1-yl)ethanone
CID 122259749
(3-pyrimidin-4-yloxypiperidin-1-yl)-(3,4,5-triethoxyphenyl)methanone
CID 122259783
(2-methylphenyl)-(3-pyrimidin-4-yloxypiperidin-1-yl)methanone
CID 122259764
2-(2-methylphenoxy)-1-(3-pyrimidin-4-yloxypiperidin-1-yl)ethanone
CID 122161052
2,2-diphenyl-1-(3-pyrimidin-4-yloxypiperidin-1-yl)ethanone
CID 122161054
1-(3-pyrimidin-4-yloxypiperidine-1-carbonyl)imidazolidin-2-one
CID 122161089
(3-pyrimidin-4-yloxypiperidin-1-yl)-(3,4,5-trimethoxyphenyl)methanone
CID 122259782
4-(1-propylsulfonylpiperidin-3-yl)oxypyrimidine
CID 122260060

Frequently Asked Questions

What is the IUPAC name of N-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide?
The IUPAC name of N-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide (CID 122260053) is N-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide.
What is the SMILES notation for N-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide?
The canonical SMILES for N-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide is CCCNC(=O)N1CCCC(Oc2ccncn2)C1.
What is the InChIKey of N-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide?
The InChIKey is MIYLAESHUJCBCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-2-6-15-13(18)17-8-3-4-11(9-17)19-12-5-7-14-10-16-12/h5,7,10-11H,2-4,6,8-9H2,1H3,(H,15,18).
What are the key properties of N-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide?
N-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-3-pyrimidin-4-yloxypiperidine-1-carboxamide is sourced from PubChem (CID 122260053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).