2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile

C15H20N4 — CID 63267750

IUPAC2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
SMILESCNCC1CCN(c2nc3c(cc2C#N)CCC3)C1
InChIInChI=1S/C15H20N4/c1-17-9-11-5-6-19(10-11)15-13(8-16)7-12-3-2-4-14(12)18-15/h7,11,17H,2-6,9-10H2,1H3
InChIKeySGWIWCKJOVBIAP-UHFFFAOYSA-N
MW256.35 g/mol
LogP1.49
Rot. Bonds3

About 2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile

2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile (PubChem CID 63267750) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
PubChem CID63267750
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
SMILESCNCC1CCN(c2nc3c(cc2C#N)CCC3)C1
InChIInChI=1S/C15H20N4/c1-17-9-11-5-6-19(10-11)15-13(8-16)7-12-3-2-4-14(12)18-15/h7,11,17H,2-6,9-10H2,1H3
InChIKeySGWIWCKJOVBIAP-UHFFFAOYSA-N
XLogP1.49
TPSA51.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile 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

(9R,13R)-4,13-dimethyl-1,3,11-triazatricyclo[7.4.0.02,7]trideca-2(7),3,5-triene
CID 44409096
(9R,13R)-13-methyl-1,3,11-triazatricyclo[7.4.0.02,7]trideca-2(7),3,5-triene-4-carbonitrile
CID 44409124
1-(2-methylpropyl)-3-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
CID 951314
trans rac-N1-(4-((6-amino-4-methylpyridin-2-yl)methyl)pyrrolidin-3-yl)ethane-1,2-diamine
CID 49837180
N1-{(+/-)-4''-[(6''''-amino-4''''-methylpyridin-2''''-yl)methyl]pyrrolidin-3''-yl}ethane-1,2-diamine tetrahydrochloride
CID 11188611
2-amino-5H,6H,7H-cyclopenta(b)pyridine-3-carbonitrile
CID 12377259
N'-[4-[(6-amino-4-methyl-2-pyridinyl)methyl]pyrrolidin-3-yl]ethane-1,2-diamine
CID 44592964
1-Methyl-1,2,3,5,6,7-hexahydrocyclopenta[b]pyrrolo[3,2-e]pyridin-4-amine
CID 3709175
4-Amino-2-(diethylamino)-6-phenylpyridine-3,5-dicarbonitrile
CID 91973291
6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine
CID 118747423
4,13-Dimethyl-1,3,11-triazatricyclo[7.4.0.02,7]trideca-2(7),3,5-triene
CID 21976539
4-Ethyl-13-methyl-1,3,11-triazatricyclo[7.4.0.02,7]trideca-2(7),3,5-triene
CID 21976575

Frequently Asked Questions

What is the IUPAC name of 2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile?
The IUPAC name of 2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile (CID 63267750) is 2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile.
What is the SMILES notation for 2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile?
The canonical SMILES for 2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile is CNCC1CCN(c2nc3c(cc2C#N)CCC3)C1.
What is the InChIKey of 2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile?
The InChIKey is SGWIWCKJOVBIAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-17-9-11-5-6-19(10-11)15-13(8-16)7-12-3-2-4-14(12)18-15/h7,11,17H,2-6,9-10H2,1H3.
What are the key properties of 2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile?
2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile has a molecular weight of 256.35 g/mol, XLogP of 1.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(methylaminomethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile is sourced from PubChem (CID 63267750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).