(2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide

C14H24N4O2 — CID 56871875

IUPAC(2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide
SMILESCc1cc(C)n(CCNC(=O)[C@H](N)CC(C)C)c(=O)n1
InChIInChI=1S/C14H24N4O2/c1-9(2)7-12(15)13(19)16-5-6-18-11(4)8-10(3)17-14(18)20/h8-9,12H,5-7,15H2,1-4H3,(H,16,19)/t12-/m1/s1
InChIKeyOYYXUCJRPAKYBW-GFCCVEGCSA-N
MW280.37 g/mol
LogP0.35
Rot. Bonds6

About (2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide

(2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide (PubChem CID 56871875) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide
PubChem CID56871875
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC Name(2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide
SMILESCc1cc(C)n(CCNC(=O)[C@H](N)CC(C)C)c(=O)n1
InChIInChI=1S/C14H24N4O2/c1-9(2)7-12(15)13(19)16-5-6-18-11(4)8-10(3)17-14(18)20/h8-9,12H,5-7,15H2,1-4H3,(H,16,19)/t12-/m1/s1
InChIKeyOYYXUCJRPAKYBW-GFCCVEGCSA-N
XLogP0.35
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2-methylpropyl)-2-oxo-N-[(3S)-2-oxopyrrolidin-3-yl]-1H-pyrimidine-4-carboxamide
CID 100055639
2-(4,6-dimethyl-2-oxopyrimidin-1-yl)-N-(3-fluoro-3-methylcyclobutyl)acetamide
CID 137993544
(Z)-4-amino-N-[(2S)-1,5-diamino-1-oxopentan-2-yl]-2-methyliminopent-3-enamide
CID 145488244
(Z)-4-amino-N-(1,5-diamino-1-oxopentan-2-yl)-2-ethyliminopent-3-enamide;propane
CID 145488365
N-[2-(dimethylamino)-2-oxoethyl]-2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)acetamide
CID 9406635
N-cyclohexyl-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanamide
CID 46304534
1-(2-{[3-(4,6-dimethyl-2-oxopyrimidin-1(2H)-yl)propanoyl]amino}ethyl)piperidine-3-carboxamide
CID 46993557
1-(2-amino-2-oxoethyl)-N-[2-(4,6-dimethyl-2-oxopyrimidin-1(2H)-yl)ethyl]piperidine-3-carboxamide
CID 46995964
N-[2-(4,6-dimethyl-2-oxopyrimidin-1(2H)-yl)ethyl]-1-isopropylpiperidine-4-carboxamide
CID 50956693
N-cyclohexyl-2-{[2-(4,6-dimethyl-2-oxopyrimidin-1(2H)-yl)ethyl]amino}butanamide
CID 50980300
(3S)-1-[2-[3-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanoylamino]ethyl]piperidine-3-carboxamide
CID 52393213
(3R)-1-[2-[3-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanoylamino]ethyl]piperidine-3-carboxamide
CID 52393215

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide?
The IUPAC name of (2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide (CID 56871875) is (2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide.
What is the SMILES notation for (2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide?
The canonical SMILES for (2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide is Cc1cc(C)n(CCNC(=O)[C@H](N)CC(C)C)c(=O)n1.
What is the InChIKey of (2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide?
The InChIKey is OYYXUCJRPAKYBW-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-9(2)7-12(15)13(19)16-5-6-18-11(4)8-10(3)17-14(18)20/h8-9,12H,5-7,15H2,1-4H3,(H,16,19)/t12-/m1/s1.
What are the key properties of (2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide?
(2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide has a molecular weight of 280.37 g/mol, XLogP of 0.35, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide is sourced from PubChem (CID 56871875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).