6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione

C24H28N6O2 — CID 78834984

IUPAC6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione
SMILESCCCCn1c(N)c(N(CC)Cc2c(-c3ccccc3)nc3ccccn23)c(=O)[nH]c1=O
InChIInChI=1S/C24H28N6O2/c1-3-5-14-30-22(25)21(23(31)27-24(30)32)28(4-2)16-18-20(17-11-7-6-8-12-17)26-19-13-9-10-15-29(18)19/h6-13,15H,3-5,14,16,25H2,1-2H3,(H,27,31,32)
InChIKeyOVBBWQGSULXJRC-UHFFFAOYSA-N
MW432.53 g/mol
LogP3.26
Rot. Bonds8

About 6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione

6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione (PubChem CID 78834984) has the molecular formula C24H28N6O2 and a molecular weight of 432.53 g/mol. Its IUPAC name is 6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione
PubChem CID78834984
Molecular FormulaC24H28N6O2
Molecular Weight432.53 g/mol
Exact Mass432.23
IUPAC Name6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione
SMILESCCCCn1c(N)c(N(CC)Cc2c(-c3ccccc3)nc3ccccn23)c(=O)[nH]c1=O
InChIInChI=1S/C24H28N6O2/c1-3-5-14-30-22(25)21(23(31)27-24(30)32)28(4-2)16-18-20(17-11-7-6-8-12-17)26-19-13-9-10-15-29(18)19/h6-13,15H,3-5,14,16,25H2,1-2H3,(H,27,31,32)
InChIKeyOVBBWQGSULXJRC-UHFFFAOYSA-N
XLogP3.26
TPSA101.42 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.53
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione with MolForge

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Related Compounds

6-amino-5-[1,3-benzoxazol-2-ylmethyl(ethyl)amino]-1-butylpyrimidine-2,4-dione
CID 18136975
6-amino-5-[2,1,3-benzothiadiazol-4-ylmethyl(ethyl)amino]-1-butylpyrimidine-2,4-dione
CID 75383466
6-amino-1-butyl-5-[ethyl-[[4-(hydroxymethyl)phenyl]methyl]amino]pyrimidine-2,4-dione
CID 110009359
6-amino-5-[benzyl-[(2-methylphenyl)methyl]amino]-1-butylpyrimidine-2,4-dione
CID 34653306
6-amino-5-[benzyl-[[2-(4-fluorophenyl)-1,3-oxazol-4-yl]methyl]amino]-1-butylpyrimidine-2,4-dione
CID 34653842
N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-methyl-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 51261970
6-amino-5-[benzyl-[(4-nitrophenyl)methyl]amino]-1-butylpyrimidine-2,4-dione
CID 33411212
2-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-ethylamino]-N-benzhydryl-N-methylacetamide
CID 55498315
4-[3-[[butyl(methyl)amino]methyl]imidazo[1,2-a]pyridin-2-yl]aniline
CID 92858211
2-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-(2-methylpropyl)amino]-N-benzyl-N-ethylacetamide
CID 55591424
3-[[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-ethylamino]methyl]-4-fluorobenzonitrile
CID 24595641
2-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-ethylamino]-N-[(2-methylphenyl)methyl]acetamide
CID 18136980

Frequently Asked Questions

What is the IUPAC name of 6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione?
The IUPAC name of 6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione (CID 78834984) is 6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione?
The canonical SMILES for 6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione is CCCCn1c(N)c(N(CC)Cc2c(-c3ccccc3)nc3ccccn23)c(=O)[nH]c1=O.
What is the InChIKey of 6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione?
The InChIKey is OVBBWQGSULXJRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N6O2/c1-3-5-14-30-22(25)21(23(31)27-24(30)32)28(4-2)16-18-20(17-11-7-6-8-12-17)26-19-13-9-10-15-29(18)19/h6-13,15H,3-5,14,16,25H2,1-2H3,(H,27,31,32).
What are the key properties of 6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione?
6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione has a molecular weight of 432.53 g/mol, XLogP of 3.26, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-butyl-5-[ethyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]pyrimidine-2,4-dione is sourced from PubChem (CID 78834984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).