2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine

C10H15N2+ — CID 7012390

IUPAC2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine
SMILESCc1[nH+]c2c(c(N)c1C)CCC2
InChIInChI=1S/C10H14N2/c1-6-7(2)12-9-5-3-4-8(9)10(6)11/h3-5H2,1-2H3,(H2,11,12)/p+1
InChIKeyXCACCLNWIIMXHQ-UHFFFAOYSA-O
MW163.24 g/mol
LogP1.19
Rot. Bonds

About 2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine

2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine (PubChem CID 7012390) has the molecular formula C10H15N2+ and a molecular weight of 163.24 g/mol. Its IUPAC name is 2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine.

Molecular Properties

Compound Name2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine
PubChem CID7012390
Molecular FormulaC10H15N2+
Molecular Weight163.24 g/mol
Exact Mass163.12
IUPAC Name2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine
SMILESCc1[nH+]c2c(c(N)c1C)CCC2
InChIInChI=1S/C10H14N2/c1-6-7(2)12-9-5-3-4-8(9)10(6)11/h3-5H2,1-2H3,(H2,11,12)/p+1
InChIKeyXCACCLNWIIMXHQ-UHFFFAOYSA-O
XLogP1.19
TPSA40.16 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.24
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-4-ium-9-amine
CID 7071102
5,7-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-4-ium-9-amine
CID 7302424
8-methyl-1,2,3,5,6,7-hexahydro-s-indacen-4-amine
CID 122480741
5,7-dimethyl-1,2,3,4-tetrahydroacridin-10-ium-9-amine
CID 6940373
6-cyclopropyl-5-methyl-2,3-dihydro-1H-inden-4-amine
CID 146570694
2-amino-4-(4-methylphenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile
CID 7395737
5,6,7,8-tetrahydronaphthalene-1,2,3,4-tetramine
CID 163637874
5-bromo-6-methyl-2,3-dihydro-1H-inden-4-amine
CID 146380579
ethane;ethene;1,2,3,5,6,7-hexahydro-s-indacen-4-amine
CID 145387694
1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene
CID 129040041
(9S)-9-methyl-1,2,3,4,7,8,9,10-octahydro-[1]benzothiolo[2,3-b]quinolin-6-ium-11-amine
CID 6924983
2-amino-4-(4-bromo-5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile
CID 4739442

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine?
The IUPAC name of 2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine (CID 7012390) is 2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine.
What is the SMILES notation for 2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine?
The canonical SMILES for 2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine is Cc1[nH+]c2c(c(N)c1C)CCC2.
What is the InChIKey of 2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine?
The InChIKey is XCACCLNWIIMXHQ-UHFFFAOYSA-O. The full InChI is InChI=1S/C10H14N2/c1-6-7(2)12-9-5-3-4-8(9)10(6)11/h3-5H2,1-2H3,(H2,11,12)/p+1.
What are the key properties of 2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine?
2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine has a molecular weight of 163.24 g/mol, XLogP of 1.19, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-amine is sourced from PubChem (CID 7012390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).