5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine

C17H22N6 — CID 5325314

IUPAC5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine
SMILESCCCNc1cc(-n2ccnc2)nc2c1=NC1(CCCCC1)N=2
InChIInChI=1S/C17H22N6/c1-2-8-19-13-11-14(23-10-9-18-12-23)20-16-15(13)21-17(22-16)6-4-3-5-7-17/h9-12,19H,2-8H2,1H3
InChIKeyNBBLFJVAWZFAKM-UHFFFAOYSA-N
MW310.40 g/mol
LogP2.00
Rot. Bonds4

About 5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine

5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine (PubChem CID 5325314) has the molecular formula C17H22N6 and a molecular weight of 310.40 g/mol. Its IUPAC name is 5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine.

Molecular Properties

Compound Name5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine
PubChem CID5325314
Molecular FormulaC17H22N6
Molecular Weight310.40 g/mol
Exact Mass310.19
IUPAC Name5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine
SMILESCCCNc1cc(-n2ccnc2)nc2c1=NC1(CCCCC1)N=2
InChIInChI=1S/C17H22N6/c1-2-8-19-13-11-14(23-10-9-18-12-23)20-16-15(13)21-17(22-16)6-4-3-5-7-17/h9-12,19H,2-8H2,1H3
InChIKeyNBBLFJVAWZFAKM-UHFFFAOYSA-N
XLogP2.00
TPSA67.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine with MolForge

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

Launch Full Analysis

Related Compounds

4-(imidazol-1-ylmethyl)-2-methyl-1H-pyrrolo[2,3-h]quinoline
CID 136244612
butane;ethane;propane;4-N-prop-1-en-2-yl-1-N-[2-(trifluoromethyl)-5,6-dihydroimidazo[1,2-a]pyridin-5-yl]cyclohexane-1,4-diamine
CID 164558133
4-N-prop-1-en-2-yl-1-N-[2-(trifluoromethyl)-5,6-dihydroimidazo[1,2-a]pyridin-5-yl]cyclohexane-1,4-diamine
CID 164558134
1-N-methyl-4-N-[2-(trifluoromethyl)-5,6-dihydroimidazo[1,2-a]pyridin-5-yl]cyclohexane-1,4-diamine
CID 164558234
5',7'-Di(imidazol-1-yl)spiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]
CID 5325313
5'-Imidazol-1-yl-7'-piperidin-1-ylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]
CID 5325315
7'-Imidazol-1-yl-5'-methoxyspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]
CID 10612975
7-imidazol-1-ylspiro[4H-imidazo[4,5-b]pyridine-2,1'-cyclohexane]-5-one
CID 10683405
4'-Imidazol-1-ylspiro[cyclohexane-1,2'-imidazo[4,5-c]pyridine]
CID 10753378
6-(3-imidazol-1-ylpropyl)-7H-pyrido[3,4-d]pyrimidine-4,6-diamine
CID 69755911
2-ethyl-5-imidazol-1-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 117611870
5-imidazol-1-yl-2-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 117614479

Frequently Asked Questions

What is the IUPAC name of 5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine?
The IUPAC name of 5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine (CID 5325314) is 5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine.
What is the SMILES notation for 5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine?
The canonical SMILES for 5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine is CCCNc1cc(-n2ccnc2)nc2c1=NC1(CCCCC1)N=2.
What is the InChIKey of 5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine?
The InChIKey is NBBLFJVAWZFAKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N6/c1-2-8-19-13-11-14(23-10-9-18-12-23)20-16-15(13)21-17(22-16)6-4-3-5-7-17/h9-12,19H,2-8H2,1H3.
What are the key properties of 5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine?
5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine has a molecular weight of 310.40 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5'-imidazol-1-yl-N-propylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-7'-amine is sourced from PubChem (CID 5325314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).