[2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone

C15H24N4O2 — CID 77097381

IUPAC[2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone
SMILESCOC1CCCN(C(=O)c2cc(CC(C)C)nc(N)n2)C1
InChIInChI=1S/C15H24N4O2/c1-10(2)7-11-8-13(18-15(16)17-11)14(20)19-6-4-5-12(9-19)21-3/h8,10,12H,4-7,9H2,1-3H3,(H2,16,17,18)
InChIKeyMGHUIYYKDLWCBQ-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.51
Rot. Bonds4

About [2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone

[2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone (PubChem CID 77097381) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is [2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone.

Molecular Properties

Compound Name[2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone
PubChem CID77097381
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name[2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone
SMILESCOC1CCCN(C(=O)c2cc(CC(C)C)nc(N)n2)C1
InChIInChI=1S/C15H24N4O2/c1-10(2)7-11-8-13(18-15(16)17-11)14(20)19-6-4-5-12(9-19)21-3/h8,10,12H,4-7,9H2,1-3H3,(H2,16,17,18)
InChIKeyMGHUIYYKDLWCBQ-UHFFFAOYSA-N
XLogP1.51
TPSA81.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-[(3R,4R)-3-hydroxy-4-methyl-3-propan-2-ylpyrrolidin-1-yl]methanone
CID 70780034
[2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-[(3S,4S)-4-(4-fluorophenyl)-3-hydroxypiperidin-1-yl]methanone
CID 50983669
(2-amino-1,3-thiazol-4-yl)-(3-methoxypiperidin-1-yl)methanone
CID 102957562
1-[1-[2-amino-6-(2-methylpropyl)pyrimidine-4-carbonyl]piperidin-4-yl]-N-propan-2-ylpiperidine-4-carboxamide
CID 26400088
[4-[2-amino-6-(2-methylpropyl)pyrimidine-4-carbonyl]piperazin-1-yl]-thiophen-2-ylmethanone
CID 131914788
(1-methoxyisoquinolin-3-yl)-(3-methoxypiperidin-1-yl)methanone
CID 75419494
[2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-[(4R,5S)-4,5-dihydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecan-9-yl]methanone
CID 163310197
(3-methoxypiperidin-1-yl)-(2-propyl-1,3-thiazol-4-yl)methanone
CID 72865941
(2-amino-6-methylpyrimidin-4-yl)-[(3R)-4-(cyclopropylmethyl)-3-propan-2-yl-1,4-diazepan-1-yl]methanone
CID 95556432
6-(2-methylpropyl)-4-[(3S)-3-(pyridin-2-ylmethoxy)piperidine-1-carbonyl]-1H-pyrimidin-2-one
CID 99950657
[2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(4-quinazolin-4-ylpiperazin-1-yl)methanone
CID 131919946
(3-amino-4-methoxyphenyl)-(3-methoxypiperidin-1-yl)methanone
CID 102955038

Frequently Asked Questions

What is the IUPAC name of [2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone?
The IUPAC name of [2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone (CID 77097381) is [2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone.
What is the SMILES notation for [2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone?
The canonical SMILES for [2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone is COC1CCCN(C(=O)c2cc(CC(C)C)nc(N)n2)C1.
What is the InChIKey of [2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone?
The InChIKey is MGHUIYYKDLWCBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-10(2)7-11-8-13(18-15(16)17-11)14(20)19-6-4-5-12(9-19)21-3/h8,10,12H,4-7,9H2,1-3H3,(H2,16,17,18).
What are the key properties of [2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone?
[2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone has a molecular weight of 292.38 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-amino-6-(2-methylpropyl)pyrimidin-4-yl]-(3-methoxypiperidin-1-yl)methanone is sourced from PubChem (CID 77097381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).