(Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane

C16H26N6 — CID 165133239

IUPAC(Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane
SMILESCC.NC/C(N)=C/N(N)Cc1cn2cc(C3CC3)ccc2n1
InChIInChI=1S/C14H20N6.C2H6/c15-5-12(16)7-20(17)9-13-8-19-6-11(10-1-2-10)3-4-14(19)18-13;1-2/h3-4,6-8,10H,1-2,5,9,15-17H2;1-2H3/b12-7-;
InChIKeyXIHVSJNTXPMTLP-OZLKFZLXSA-N
MW302.43 g/mol
LogP1.67
Rot. Bonds5

About (Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane

(Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane (PubChem CID 165133239) has the molecular formula C16H26N6 and a molecular weight of 302.43 g/mol. Its IUPAC name is (Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane.

Molecular Properties

Compound Name(Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane
PubChem CID165133239
Molecular FormulaC16H26N6
Molecular Weight302.43 g/mol
Exact Mass302.22
IUPAC Name(Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane
SMILESCC.NC/C(N)=C/N(N)Cc1cn2cc(C3CC3)ccc2n1
InChIInChI=1S/C14H20N6.C2H6/c15-5-12(16)7-20(17)9-13-8-19-6-11(10-1-2-10)3-4-14(19)18-13;1-2/h3-4,6-8,10H,1-2,5,9,15-17H2;1-2H3/b12-7-;
InChIKeyXIHVSJNTXPMTLP-OZLKFZLXSA-N
XLogP1.67
TPSA98.60 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.43
LogP ≤ 51.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane?
The IUPAC name of (Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane (CID 165133239) is (Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane.
What is the SMILES notation for (Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane?
The canonical SMILES for (Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane is CC.NC/C(N)=C/N(N)Cc1cn2cc(C3CC3)ccc2n1.
What is the InChIKey of (Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane?
The InChIKey is XIHVSJNTXPMTLP-OZLKFZLXSA-N. The full InChI is InChI=1S/C14H20N6.C2H6/c15-5-12(16)7-20(17)9-13-8-19-6-11(10-1-2-10)3-4-14(19)18-13;1-2/h3-4,6-8,10H,1-2,5,9,15-17H2;1-2H3/b12-7-;.
What are the key properties of (Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane?
(Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane has a molecular weight of 302.43 g/mol, XLogP of 1.67, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]prop-2-ene-1,2-diamine;ethane is sourced from PubChem (CID 165133239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).