1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one

C13H20N4O — CID 62492392

IUPAC1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one
SMILESCCCNc1ccc(CN2CCN(C)C2=O)cn1
InChIInChI=1S/C13H20N4O/c1-3-6-14-12-5-4-11(9-15-12)10-17-8-7-16(2)13(17)18/h4-5,9H,3,6-8,10H2,1-2H3,(H,14,15)
InChIKeyGUEJWPHSVSWLNO-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.77
Rot. Bonds5

About 1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one

1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one (PubChem CID 62492392) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one
PubChem CID62492392
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one
SMILESCCCNc1ccc(CN2CCN(C)C2=O)cn1
InChIInChI=1S/C13H20N4O/c1-3-6-14-12-5-4-11(9-15-12)10-17-8-7-16(2)13(17)18/h4-5,9H,3,6-8,10H2,1-2H3,(H,14,15)
InChIKeyGUEJWPHSVSWLNO-UHFFFAOYSA-N
XLogP1.77
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(1-oxo-1,4-thiazinan-4-yl)methyl]-N-propylpyridin-2-amine
CID 55046608
5-[(7,7-dimethyl-1,4-thiazepan-4-yl)methyl]-N-propylpyridin-2-amine
CID 107459113
4-methyl-1-[[6-(propylamino)-3-pyridinyl]methyl]piperidin-3-ol
CID 102966649
3-[[6-(propylamino)-3-pyridinyl]methyl]-1,3-benzoxazol-2-one
CID 62208505
5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine
CID 62183438
1-[[6-(ethylamino)-3-pyridinyl]methyl]-3-methylpiperidin-2-one
CID 104680386
5-[(3-ethoxypiperidin-1-yl)methyl]-N-propylpyridin-2-amine
CID 62207953
5-[(4-ethylphenoxy)methyl]-N-propylpyridin-2-amine
CID 62194753
5-[(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methyl]-N-propylpyridin-2-amine
CID 79932442
5-[(dipropylamino)methyl]-N-propylpyridin-2-amine
CID 62183383
5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine
CID 62193904
N-propyl-5-(pyrimidin-2-ylsulfanylmethyl)pyridin-2-amine
CID 62189823

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one?
The IUPAC name of 1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one (CID 62492392) is 1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one.
What is the SMILES notation for 1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one?
The canonical SMILES for 1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one is CCCNc1ccc(CN2CCN(C)C2=O)cn1.
What is the InChIKey of 1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one?
The InChIKey is GUEJWPHSVSWLNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-3-6-14-12-5-4-11(9-15-12)10-17-8-7-16(2)13(17)18/h4-5,9H,3,6-8,10H2,1-2H3,(H,14,15).
What are the key properties of 1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one?
1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one has a molecular weight of 248.33 g/mol, XLogP of 1.77, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[[6-(propylamino)-3-pyridinyl]methyl]imidazolidin-2-one is sourced from PubChem (CID 62492392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).