5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide

C14H26N4O2 — CID 164864926

IUPAC5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide
SMILESCCC1(CC)CC(=O)N(CC(C)CCC(N)=O)C(N)=N1
InChIInChI=1S/C14H26N4O2/c1-4-14(5-2)8-12(20)18(13(16)17-14)9-10(3)6-7-11(15)19/h10H,4-9H2,1-3H3,(H2,15,19)(H2,16,17)
InChIKeyQFIRRPHNXUDRHQ-UHFFFAOYSA-N
MW282.39 g/mol
LogP0.99
Rot. Bonds7

About 5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide

5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide (PubChem CID 164864926) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide.

Molecular Properties

Compound Name5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide
PubChem CID164864926
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide
SMILESCCC1(CC)CC(=O)N(CC(C)CCC(N)=O)C(N)=N1
InChIInChI=1S/C14H26N4O2/c1-4-14(5-2)8-12(20)18(13(16)17-14)9-10(3)6-7-11(15)19/h10H,4-9H2,1-3H3,(H2,15,19)(H2,16,17)
InChIKeyQFIRRPHNXUDRHQ-UHFFFAOYSA-N
XLogP0.99
TPSA101.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

cis-(1R,2R)-2-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-1-phenylethyl]cyclopropane-1-carboxamide
CID 166591182
2-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-(1-phenylethyl)cyclopropane-1-carboxamide
CID 164864896
(2S)-2-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]cyclopropane-1-carboxamide
CID 164864792
2-amino-3-[(R)-(2,2-dimethylcyclopropyl)-pyridin-3-ylmethyl]-6,6-diethyl-5H-pyrimidin-4-one
CID 156742907
trans-(1R,2R)-2-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-3-methylcyclopropane-1-carboxamide
CID 171442177
cis-(1S,2S)-2-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(4S)-2,2-dimethyl-3,4-dihydrochromen-4-yl]cyclopropane-1-carboxamide
CID 171442024
4,7-dimethyloctanamide
CID 16638041
6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide
CID 166705833
3-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(4S)-6-bromo-3,4-dihydro-2H-chromen-4-yl]benzamide
CID 166705771
(2R)-2-methylpentanediamide
CID 90202517
2-methylpentanediamide
CID 19688970
(6R)-2-amino-3-(cyclopropylmethyl)-6-ethyl-6-methyl-5H-pyrimidin-4-one
CID 164865049

Frequently Asked Questions

What is the IUPAC name of 5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide?
The IUPAC name of 5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide (CID 164864926) is 5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide.
What is the SMILES notation for 5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide?
The canonical SMILES for 5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide is CCC1(CC)CC(=O)N(CC(C)CCC(N)=O)C(N)=N1.
What is the InChIKey of 5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide?
The InChIKey is QFIRRPHNXUDRHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-4-14(5-2)8-12(20)18(13(16)17-14)9-10(3)6-7-11(15)19/h10H,4-9H2,1-3H3,(H2,15,19)(H2,16,17).
What are the key properties of 5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide?
5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide has a molecular weight of 282.39 g/mol, XLogP of 0.99, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-4-methylpentanamide is sourced from PubChem (CID 164864926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).