N-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide

C15H22N4O2 — CID 136792779

IUPACN-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(c2cc(=O)[nH]c(C3CC3)n2)CC1
InChIInChI=1S/C15H22N4O2/c1-10(20)16-9-11-4-6-19(7-5-11)13-8-14(21)18-15(17-13)12-2-3-12/h8,11-12H,2-7,9H2,1H3,(H,16,20)(H,17,18,21)
InChIKeyHGDLAGASHWEVIZ-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.00
Rot. Bonds4

About N-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide

N-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide (PubChem CID 136792779) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide
PubChem CID136792779
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(c2cc(=O)[nH]c(C3CC3)n2)CC1
InChIInChI=1S/C15H22N4O2/c1-10(20)16-9-11-4-6-19(7-5-11)13-8-14(21)18-15(17-13)12-2-3-12/h8,11-12H,2-7,9H2,1H3,(H,16,20)(H,17,18,21)
InChIKeyHGDLAGASHWEVIZ-UHFFFAOYSA-N
XLogP1.00
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4,6-dihydroxy-2-pyrimidinyl)ethyl]-2-(1-ethyl-4-piperidinyl)acetamide
CID 72874444
N-[2-(4-amino-6-hydroxy-2-pyrimidinyl)ethyl]-2-(1-ethyl-4-piperidinyl)acetamide
CID 136216738
2-cyclopropyl-4-[3-(trifluoromethyl)piperidin-1-yl]-1H-pyrimidin-6-one
CID 137009790
2-propan-2-yl-4-[4-(trifluoromethyl)piperidin-1-yl]-1H-pyrimidin-6-one
CID 137009792
2-ethyl-4-[4-(trifluoromethyl)piperidin-1-yl]-1H-pyrimidin-6-one
CID 137009795
2-cyclopropyl-4-[4-(trifluoromethyl)piperidin-1-yl]-1H-pyrimidin-6-one
CID 137009796
N-{[4-fluoro-1-(1-methyl-6-oxo-1,6-dihydropyrimidin-4-yl)piperidin-4-yl]methyl}acetamide
CID 165431804
N-{[4-fluoro-1-(1-methyl-6-oxo-1,6-dihydropyrimidin-4-yl)piperidin-4-yl]methyl}cyclopropanecarboxamide
CID 175648121
2-(1-ethylpiperidin-4-yl)-4-hydroxy-1H-pyrimidin-6-one
CID 22618160
ethane;2-(piperidin-4-ylmethyl)-1H-pyrimidin-6-one
CID 91106069
ethane;2-(piperidin-4-ylmethyl)-1H-pyrimidin-6-one
CID 91221143
N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide
CID 175761646

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide?
The IUPAC name of N-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide (CID 136792779) is N-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide.
What is the SMILES notation for N-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide?
The canonical SMILES for N-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide is CC(=O)NCC1CCN(c2cc(=O)[nH]c(C3CC3)n2)CC1.
What is the InChIKey of N-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide?
The InChIKey is HGDLAGASHWEVIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-10(20)16-9-11-4-6-19(7-5-11)13-8-14(21)18-15(17-13)12-2-3-12/h8,11-12H,2-7,9H2,1H3,(H,16,20)(H,17,18,21).
What are the key properties of N-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide?
N-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide has a molecular weight of 290.37 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]acetamide is sourced from PubChem (CID 136792779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).