CID 87288392

C9H17N4Sn — CID 87288392

IUPAC—
SMILESCCCNc1cnc([Sn])cn1.CNC
InChIInChI=1S/C7H10N3.C2H7N.Sn/c1-2-3-9-7-6-8-4-5-10-7;1-3-2;/h5-6H,2-3H2,1H3,(H,9,10);3H,1-2H3;
InChIKeyLMRLZZPOTNPJBL-UHFFFAOYSA-N
MW299.97 g/mol
LogP-0.07
Rot. Bonds3

About CID 87288392

CID 87288392 (PubChem CID 87288392) has the molecular formula C9H17N4Sn and a molecular weight of 299.97 g/mol.

Molecular Properties

Compound NameCID 87288392
PubChem CID87288392
Molecular FormulaC9H17N4Sn
Molecular Weight299.97 g/mol
Exact Mass301.05
IUPAC Name—
SMILESCCCNc1cnc([Sn])cn1.CNC
InChIInChI=1S/C7H10N3.C2H7N.Sn/c1-2-3-9-7-6-8-4-5-10-7;1-3-2;/h5-6H,2-3H2,1H3,(H,9,10);3H,1-2H3;
InChIKeyLMRLZZPOTNPJBL-UHFFFAOYSA-N
XLogP-0.07
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.97
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-propyl-5-(propylaminomethyl)pyrazin-2-amine
CID 107380778
5-N-ethyl-2-N-propylpyridine-2,5-diamine
CID 82104306
5-methoxy-N-propylpyridin-2-amine
CID 106503925
N-(2-methylbutan-2-yl)-5-(propylamino)pyrazine-2-carboxamide
CID 107374127
5-(3,3-dimethylbutoxymethyl)-N-propylpyrazin-2-amine
CID 103059228
5-(2-butoxyethoxymethyl)-N-propylpyrazin-2-amine
CID 103058513
N-(4-methylpentyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107375562
5-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propylpyrazin-2-amine
CID 103056605
N-(2-methoxyethyl)-5-(propylamino)pyrazine-2-carboxamide
CID 109270966
N-(3,3-dimethylbutyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107376964
5-[(3,5-difluorophenoxy)methyl]-N-propylpyrazin-2-amine
CID 103059023
5-(difluoromethyl)-N-propylpyridin-2-amine
CID 130559266

Frequently Asked Questions

What is the IUPAC name of CID 87288392?
The IUPAC name of CID 87288392 (CID 87288392) is not available.
What is the SMILES notation for CID 87288392?
The canonical SMILES for CID 87288392 is CCCNc1cnc([Sn])cn1.CNC.
What is the InChIKey of CID 87288392?
The InChIKey is LMRLZZPOTNPJBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N3.C2H7N.Sn/c1-2-3-9-7-6-8-4-5-10-7;1-3-2;/h5-6H,2-3H2,1H3,(H,9,10);3H,1-2H3;.
What are the key properties of CID 87288392?
CID 87288392 has a molecular weight of 299.97 g/mol, XLogP of -0.07, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87288392 is sourced from PubChem (CID 87288392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).