[6-(methylamino)-3-pyridinyl]urea

C7H10N4O — CID 130725566

IUPAC[6-(methylamino)-3-pyridinyl]urea
SMILESCNc1ccc(NC(N)=O)cn1
InChIInChI=1S/C7H10N4O/c1-9-6-3-2-5(4-10-6)11-7(8)12/h2-4H,1H3,(H,9,10)(H3,8,11,12)
InChIKeyPIRVYTCHSPVRDL-UHFFFAOYSA-N
MW166.18 g/mol
LogP0.61
Rot. Bonds2

About [6-(methylamino)-3-pyridinyl]urea

[6-(methylamino)-3-pyridinyl]urea (PubChem CID 130725566) has the molecular formula C7H10N4O and a molecular weight of 166.18 g/mol. Its IUPAC name is [6-(methylamino)-3-pyridinyl]urea.

Molecular Properties

Compound Name[6-(methylamino)-3-pyridinyl]urea
PubChem CID130725566
Molecular FormulaC7H10N4O
Molecular Weight166.18 g/mol
Exact Mass166.09
IUPAC Name[6-(methylamino)-3-pyridinyl]urea
SMILESCNc1ccc(NC(N)=O)cn1
InChIInChI=1S/C7H10N4O/c1-9-6-3-2-5(4-10-6)11-7(8)12/h2-4H,1H3,(H,9,10)(H3,8,11,12)
InChIKeyPIRVYTCHSPVRDL-UHFFFAOYSA-N
XLogP0.61
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 50.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-[6-(methylamino)-3-pyridinyl]-3-phenylurea
CID 115268499
2-ethyl-N-[6-(methylamino)-3-pyridinyl]butanamide
CID 115268467
1-(3-fluorophenyl)-3-[6-(methylamino)-3-pyridinyl]urea
CID 146121634
2-cyclohexyl-N-[6-(methylamino)-3-pyridinyl]acetamide
CID 115274700
2-[6-(methylamino)-3-pyridinyl]acetamide
CID 173127949
N-[6-(methylamino)-3-pyridinyl]-2-thiophen-2-ylacetamide
CID 115268484
2-[5-(carbamoylamino)-2-pyridinyl]acetic acid
CID 107339512
N-[6-(butanoylamino)-3-pyridinyl]-2,2-dimethylpropanamide
CID 1452758
2-(5-bromo-2-fluorophenyl)-N-[6-(methylamino)-3-pyridinyl]acetamide
CID 115274693
1-[6-(methylamino)-3-pyridinyl]-3-(1-methylsulfonylpiperidin-4-yl)urea
CID 53498208
N-[6-(methylamino)-3-pyridinyl]-4-(1H-pyrrol-3-yl)butanamide
CID 115274733
N-(5-fluoro-2-pyridinyl)-6-(methylamino)pyridine-3-carboxamide
CID 65482281

Frequently Asked Questions

What is the IUPAC name of [6-(methylamino)-3-pyridinyl]urea?
The IUPAC name of [6-(methylamino)-3-pyridinyl]urea (CID 130725566) is [6-(methylamino)-3-pyridinyl]urea.
What is the SMILES notation for [6-(methylamino)-3-pyridinyl]urea?
The canonical SMILES for [6-(methylamino)-3-pyridinyl]urea is CNc1ccc(NC(N)=O)cn1.
What is the InChIKey of [6-(methylamino)-3-pyridinyl]urea?
The InChIKey is PIRVYTCHSPVRDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4O/c1-9-6-3-2-5(4-10-6)11-7(8)12/h2-4H,1H3,(H,9,10)(H3,8,11,12).
What are the key properties of [6-(methylamino)-3-pyridinyl]urea?
[6-(methylamino)-3-pyridinyl]urea has a molecular weight of 166.18 g/mol, XLogP of 0.61, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(methylamino)-3-pyridinyl]urea is sourced from PubChem (CID 130725566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).