2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide

C15H21N3O — CID 66323708

IUPAC2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1cc2c(nc1OCC1CCCC1)CCC2
InChIInChI=1S/C15H21N3O/c16-14(17)12-8-11-6-3-7-13(11)18-15(12)19-9-10-4-1-2-5-10/h8,10H,1-7,9H2,(H3,16,17)
InChIKeySDBPFUNTMHVPKI-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.42
Rot. Bonds4

About 2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide

2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide (PubChem CID 66323708) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide.

Molecular Properties

Compound Name2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide
PubChem CID66323708
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1cc2c(nc1OCC1CCCC1)CCC2
InChIInChI=1S/C15H21N3O/c16-14(17)12-8-11-6-3-7-13(11)18-15(12)19-9-10-4-1-2-5-10/h8,10H,1-7,9H2,(H3,16,17)
InChIKeySDBPFUNTMHVPKI-UHFFFAOYSA-N
XLogP2.42
TPSA71.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-(piperidin-4-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 62349230
2-[2-(2-methylpropoxy)ethoxy]-5,6,7,8-tetrahydroquinoline-3-carboximidamide
CID 106447803
2-(2-ethylhexoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide
CID 63523815
2-(1-ethoxypropan-2-yloxy)-5,6,7,8-tetrahydroquinoline-3-carboximidamide
CID 103488627
2-[(5-chloro-3-pyridinyl)oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide
CID 64601771
2-(2-fluoro-3-methylphenoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide
CID 107658503
2-(4-propylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide
CID 62201293
3-(cyclopropylmethoxy)pyridazine-4-carboximidamide
CID 80514099
[2-(oxan-4-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine
CID 55067437
2-(cyclopentylmethoxy)-5-methylbenzenecarboximidamide
CID 107930853
2-[methyl(2-methylbutan-2-yl)amino]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide
CID 63981692
2-[2-ethoxyethyl(ethyl)amino]-5,6,7,8-tetrahydroquinoline-3-carboximidamide
CID 63697557

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide?
The IUPAC name of 2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide (CID 66323708) is 2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide.
What is the SMILES notation for 2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide?
The canonical SMILES for 2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide is [H]/N=C(\N)c1cc2c(nc1OCC1CCCC1)CCC2.
What is the InChIKey of 2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide?
The InChIKey is SDBPFUNTMHVPKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c16-14(17)12-8-11-6-3-7-13(11)18-15(12)19-9-10-4-1-2-5-10/h8,10H,1-7,9H2,(H3,16,17).
What are the key properties of 2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide?
2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide has a molecular weight of 259.35 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide is sourced from PubChem (CID 66323708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).