CID 59694563

C10H15N3 — CID 59694563

IUPAC—
SMILES[CH]C1CCN(Cc2nc[nH]c2C)C1
InChIInChI=1S/C10H15N3/c1-8-3-4-13(5-8)6-10-9(2)11-7-12-10/h1,7-8H,3-6H2,2H3,(H,11,12)
InChIKeyOJWUCNRFDVWOKH-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.25
Rot. Bonds2

About CID 59694563

CID 59694563 (PubChem CID 59694563) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol.

Molecular Properties

Compound NameCID 59694563
PubChem CID59694563
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name—
SMILES[CH]C1CCN(Cc2nc[nH]c2C)C1
InChIInChI=1S/C10H15N3/c1-8-3-4-13(5-8)6-10-9(2)11-7-12-10/h1,7-8H,3-6H2,2H3,(H,11,12)
InChIKeyOJWUCNRFDVWOKH-UHFFFAOYSA-N
XLogP1.25
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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3-Isopentylpurin-6-amine
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1-(5-methyl-1H-imidazol-4-yl)methanamine hydrochloride
CID 56773750
1-methyl-4-[(5-methyl-1H-imidazol-4-yl)methyl]piperazine
CID 3817838
1-[(4-methyl-1H-imidazol-5-yl)methyl]azocane
CID 6456284
N-[(5-methyl-1H-imidazol-4-yl)methyl]cyclohexanamine
CID 42776872
2,4,5-Tris(dimethylaminomethyl)imidazole
CID 1497411
1-Ethyl-6,7-dihydropurin-6-amine
CID 57484886
(4-methyl-1H-imidazol-5-yl)methanamine
CID 20393969
1,4,5,6-Tetrahydropyrrolo[3,4-d]imidazole
CID 45120616
1-cyano-2-methyl-3-[2-[[4-(trifluoromethyl)-1H-imidazol-5-yl]methylamino]ethyl]guanidine
CID 57180390

Frequently Asked Questions

What is the IUPAC name of CID 59694563?
The IUPAC name of CID 59694563 (CID 59694563) is not available.
What is the SMILES notation for CID 59694563?
The canonical SMILES for CID 59694563 is [CH]C1CCN(Cc2nc[nH]c2C)C1.
What is the InChIKey of CID 59694563?
The InChIKey is OJWUCNRFDVWOKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-8-3-4-13(5-8)6-10-9(2)11-7-12-10/h1,7-8H,3-6H2,2H3,(H,11,12).
What are the key properties of CID 59694563?
CID 59694563 has a molecular weight of 177.25 g/mol, XLogP of 1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59694563 is sourced from PubChem (CID 59694563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).