6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione

C10H18N4O2 — CID 2393504

IUPAC6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione
SMILESCCCCn1c(N)c(NCC)c(=O)[nH]c1=O
InChIInChI=1S/C10H18N4O2/c1-3-5-6-14-8(11)7(12-4-2)9(15)13-10(14)16/h12H,3-6,11H2,1-2H3,(H,13,15,16)
InChIKeyPBVLBCUSOSAXLM-UHFFFAOYSA-N
MW226.28 g/mol
LogP0.35
Rot. Bonds5

About 6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione

6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione (PubChem CID 2393504) has the molecular formula C10H18N4O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is 6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione
PubChem CID2393504
Molecular FormulaC10H18N4O2
Molecular Weight226.28 g/mol
Exact Mass226.14
IUPAC Name6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione
SMILESCCCCn1c(N)c(NCC)c(=O)[nH]c1=O
InChIInChI=1S/C10H18N4O2/c1-3-5-6-14-8(11)7(12-4-2)9(15)13-10(14)16/h12H,3-6,11H2,1-2H3,(H,13,15,16)
InChIKeyPBVLBCUSOSAXLM-UHFFFAOYSA-N
XLogP0.35
TPSA92.91 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 50.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5-Acetylamino-6-amino-3-methyluracil
CID 88299
6-Amino-5-(butylamino)-1-(2-methylpropyl)-2,4(1H,3H)-pyrimidinedione
CID 3813450
5-Acetylamino-6-formylamino-3-methyluracil
CID 108214
6-Amino-5-(butylamino)-1-propylpyrimidine-2,4(1H,3H)-dione
CID 2398074
6-amino-5-(dodecylamino)-1H-pyrimidine-2,4-dione
CID 10018296
6-Amino-1-Butyl-5-(Cyclopentylamino)pyrimidine-2,4(1h,3h)-Dione
CID 2363705
6-Amino-1-methyl-5-(1-piperidinyl)-2,4(1H,3H)-pyrimidinedione
CID 2497562
6-Amino-1-butyl-5-(propylamino)-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 2363721
6-Amino-1-butyl-5-[(2-methylpropyl)amino]-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 2384333
1-Decyl-5,6-diamino-pyrimidine-2,4-dione
CID 9971024
1-Octyl-5,6-diAm-pyrimidin-2,4-dione
CID 9992492
5,6-diamino-3-dodecyl-1H-pyrimidine-2,4-dione
CID 10086748

Frequently Asked Questions

What is the IUPAC name of 6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione?
The IUPAC name of 6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione (CID 2393504) is 6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione?
The canonical SMILES for 6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione is CCCCn1c(N)c(NCC)c(=O)[nH]c1=O.
What is the InChIKey of 6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione?
The InChIKey is PBVLBCUSOSAXLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2/c1-3-5-6-14-8(11)7(12-4-2)9(15)13-10(14)16/h12H,3-6,11H2,1-2H3,(H,13,15,16).
What are the key properties of 6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione?
6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione has a molecular weight of 226.28 g/mol, XLogP of 0.35, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-butyl-5-(ethylamino)pyrimidine-2,4-dione is sourced from PubChem (CID 2393504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).