N-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide

C15H22N4O2 — CID 166605954

IUPACN-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide
SMILESCOc1cnc(N2CCCC(N(C)C(=O)C3CC3)C2)nc1
InChIInChI=1S/C15H22N4O2/c1-18(14(20)11-5-6-11)12-4-3-7-19(10-12)15-16-8-13(21-2)9-17-15/h8-9,11-12H,3-7,10H2,1-2H3
InChIKeyIIKBSBJWVDMMDW-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.32
Rot. Bonds4

About N-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide

N-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide (PubChem CID 166605954) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide.

Molecular Properties

Compound NameN-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide
PubChem CID166605954
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide
SMILESCOc1cnc(N2CCCC(N(C)C(=O)C3CC3)C2)nc1
InChIInChI=1S/C15H22N4O2/c1-18(14(20)11-5-6-11)12-4-3-7-19(10-12)15-16-8-13(21-2)9-17-15/h8-9,11-12H,3-7,10H2,1-2H3
InChIKeyIIKBSBJWVDMMDW-UHFFFAOYSA-N
XLogP1.32
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]cyclobutanecarboxamide
CID 171335318
tert-butyl N-[(3R)-1-(5-chloropyrimidin-2-yl)piperidin-3-yl]-N-methylcarbamate
CID 97166895
N-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide
CID 166605920
tert-butyl N-[1-(5-bromopyrimidin-2-yl)piperidin-3-yl]-N-methylcarbamate
CID 140914655
N-[1-(5-chloro-3-fluoro-2-pyridinyl)piperidin-3-yl]-N-methylcyclobutanecarboxamide
CID 166605987
N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide
CID 124952652
N-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-3-yl)cyclopropanecarboxamide
CID 166602913
2-(azetidin-1-yl)-5-methoxypyrimidine
CID 163343627
1-[1-(4,6-dimethoxypyrimidin-2-yl)piperidin-3-yl]-1,3,3-trimethylurea
CID 171324316
1-(5-methoxypyrimidin-2-yl)piperidine-4-carboxamide
CID 154883318
N-methyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-3-yl]cyclopropanecarboxamide
CID 166602908
N-methyl-N-[1-(7-methylpyrrolo[2,3-d]pyrimidin-4-yl)piperidin-3-yl]cyclopropanecarboxamide
CID 166602904

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide?
The IUPAC name of N-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide (CID 166605954) is N-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide.
What is the SMILES notation for N-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide?
The canonical SMILES for N-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide is COc1cnc(N2CCCC(N(C)C(=O)C3CC3)C2)nc1.
What is the InChIKey of N-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide?
The InChIKey is IIKBSBJWVDMMDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-18(14(20)11-5-6-11)12-4-3-7-19(10-12)15-16-8-13(21-2)9-17-15/h8-9,11-12H,3-7,10H2,1-2H3.
What are the key properties of N-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide?
N-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide has a molecular weight of 290.37 g/mol, XLogP of 1.32, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]-N-methylcyclopropanecarboxamide is sourced from PubChem (CID 166605954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).