5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one

C10H16N4O — CID 135741811

IUPAC5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one
SMILESNc1c(NC2CCCCC2)nc[nH]c1=O
InChIInChI=1S/C10H16N4O/c11-8-9(12-6-13-10(8)15)14-7-4-2-1-3-5-7/h6-7H,1-5,11H2,(H2,12,13,14,15)
InChIKeyOZQINOJZUUKHGP-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.10
Rot. Bonds2

About 5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one

5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one (PubChem CID 135741811) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one
PubChem CID135741811
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one
SMILESNc1c(NC2CCCCC2)nc[nH]c1=O
InChIInChI=1S/C10H16N4O/c11-8-9(12-6-13-10(8)15)14-7-4-2-1-3-5-7/h6-7H,1-5,11H2,(H2,12,13,14,15)
InChIKeyOZQINOJZUUKHGP-UHFFFAOYSA-N
XLogP1.10
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 136418258
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CID 136423385
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CID 136423435

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one?
The IUPAC name of 5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one (CID 135741811) is 5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one.
What is the SMILES notation for 5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one?
The canonical SMILES for 5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one is Nc1c(NC2CCCCC2)nc[nH]c1=O.
What is the InChIKey of 5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one?
The InChIKey is OZQINOJZUUKHGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c11-8-9(12-6-13-10(8)15)14-7-4-2-1-3-5-7/h6-7H,1-5,11H2,(H2,12,13,14,15).
What are the key properties of 5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one?
5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one has a molecular weight of 208.26 g/mol, XLogP of 1.10, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-(cyclohexylamino)-1H-pyrimidin-6-one is sourced from PubChem (CID 135741811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).