N-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine

C15H14F2N2 — CID 102773684

IUPACN-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
SMILESFc1ccc(CNC2CCc3cccnc32)c(F)c1
InChIInChI=1S/C15H14F2N2/c16-12-5-3-11(13(17)8-12)9-19-14-6-4-10-2-1-7-18-15(10)14/h1-3,5,7-8,14,19H,4,6,9H2
InChIKeySDDTUPVYLVOXBG-UHFFFAOYSA-N
MW260.29 g/mol
LogP3.14
Rot. Bonds3

About N-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine

N-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine (PubChem CID 102773684) has the molecular formula C15H14F2N2 and a molecular weight of 260.29 g/mol. Its IUPAC name is N-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine.

Molecular Properties

Compound NameN-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
PubChem CID102773684
Molecular FormulaC15H14F2N2
Molecular Weight260.29 g/mol
Exact Mass260.11
IUPAC NameN-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
SMILESFc1ccc(CNC2CCc3cccnc32)c(F)c1
InChIInChI=1S/C15H14F2N2/c16-12-5-3-11(13(17)8-12)9-19-14-6-4-10-2-1-7-18-15(10)14/h1-3,5,7-8,14,19H,4,6,9H2
InChIKeySDDTUPVYLVOXBG-UHFFFAOYSA-N
XLogP3.14
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2,4-difluorophenyl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine
CID 79079238
N-[(3-fluorophenyl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine
CID 79078877
N-(2-bromo-4,6-difluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
CID 102772831
N-(2,5-difluorophenyl)-5,6,7,8-tetrahydroquinolin-8-amine
CID 79079820
N-[[4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
CID 71026047
N-(4-bromo-3-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
CID 102773903
N-but-3-ynyl-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
CID 102773823
N-[[5-(3-fluorophenyl)-1H-imidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
CID 141048926
(8S)-N-benzyl-5,6,7,8-tetrahydroquinolin-8-amine
CID 11736560
N-[[5-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]pyrazin-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
CID 74539206
N-(1,2-oxazol-5-ylmethyl)-5,6,7,8-tetrahydroquinolin-8-amine
CID 114185955
2-(2-chloro-4-fluorophenyl)-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine
CID 79732033

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine?
The IUPAC name of N-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine (CID 102773684) is N-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine.
What is the SMILES notation for N-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine?
The canonical SMILES for N-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine is Fc1ccc(CNC2CCc3cccnc32)c(F)c1.
What is the InChIKey of N-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine?
The InChIKey is SDDTUPVYLVOXBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2/c16-12-5-3-11(13(17)8-12)9-19-14-6-4-10-2-1-7-18-15(10)14/h1-3,5,7-8,14,19H,4,6,9H2.
What are the key properties of N-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine?
N-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine has a molecular weight of 260.29 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-difluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine is sourced from PubChem (CID 102773684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).