1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol

C16H25N3O — CID 114947832

IUPAC1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol
SMILESCN(CC1(O)CCCC1)c1nc2c(cc1CN)CCC2
InChIInChI=1S/C16H25N3O/c1-19(11-16(20)7-2-3-8-16)15-13(10-17)9-12-5-4-6-14(12)18-15/h9,20H,2-8,10-11,17H2,1H3
InChIKeyFGGDOWGAJVTLJB-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.77
Rot. Bonds4

About 1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol

1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol (PubChem CID 114947832) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol
PubChem CID114947832
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol
SMILESCN(CC1(O)CCCC1)c1nc2c(cc1CN)CCC2
InChIInChI=1S/C16H25N3O/c1-19(11-16(20)7-2-3-8-16)15-13(10-17)9-12-5-4-6-14(12)18-15/h9,20H,2-8,10-11,17H2,1H3
InChIKeyFGGDOWGAJVTLJB-UHFFFAOYSA-N
XLogP1.77
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol with MolForge

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Related Compounds

1-[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]propan-2-ol
CID 62332661
3-(aminomethyl)-N-(3-methoxypropyl)-N-methyl-5,6,7,8-tetrahydroquinolin-2-amine
CID 62984087
3-(aminomethyl)-N-methyl-N-(2-phenylethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
CID 65485060
1-[[[3-(aminomethyl)-4,6-dimethyl-2-pyridinyl]-methylamino]methyl]cyclopentan-1-ol
CID 114947854
[2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine
CID 62935971
3-(aminomethyl)-N-methyl-N-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroquinolin-2-amine
CID 63726407
3-(aminomethyl)-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
CID 79303751
3-[[3-(aminomethyl)-5,6,7,8-tetrahydroquinolin-2-yl]-methylamino]phenol
CID 107733671
[2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine
CID 63215740
3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
CID 82732653
1-[[2-(aminomethyl)-4-chloro-N-methylanilino]methyl]cyclopentan-1-ol
CID 114947842
1-[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-N,N-dimethylpyrazole-3-carboxamide
CID 64782087

Frequently Asked Questions

What is the IUPAC name of 1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol (CID 114947832) is 1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol is CN(CC1(O)CCCC1)c1nc2c(cc1CN)CCC2.
What is the InChIKey of 1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol?
The InChIKey is FGGDOWGAJVTLJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-19(11-16(20)7-2-3-8-16)15-13(10-17)9-12-5-4-6-14(12)18-15/h9,20H,2-8,10-11,17H2,1H3.
What are the key properties of 1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol?
1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol has a molecular weight of 275.40 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 114947832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).