N-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine

C11H13FN4 — CID 126857850

IUPACN-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
SMILESFC1CCCC1Nc1ncnc2[nH]ccc12
InChIInChI=1S/C11H13FN4/c12-8-2-1-3-9(8)16-11-7-4-5-13-10(7)14-6-15-11/h4-6,8-9H,1-3H2,(H2,13,14,15,16)
InChIKeyDSFAZAMXEWEMEO-UHFFFAOYSA-N
MW220.25 g/mol
LogP2.26
Rot. Bonds2

About N-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine

N-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine (PubChem CID 126857850) has the molecular formula C11H13FN4 and a molecular weight of 220.25 g/mol. Its IUPAC name is N-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
PubChem CID126857850
Molecular FormulaC11H13FN4
Molecular Weight220.25 g/mol
Exact Mass220.11
IUPAC NameN-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
SMILESFC1CCCC1Nc1ncnc2[nH]ccc12
InChIInChI=1S/C11H13FN4/c12-8-2-1-3-9(8)16-11-7-4-5-13-10(7)14-6-15-11/h4-6,8-9H,1-3H2,(H2,13,14,15,16)
InChIKeyDSFAZAMXEWEMEO-UHFFFAOYSA-N
XLogP2.26
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.25
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,3-difluoropiperidin-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 145134213
N-(2-fluorocyclopentyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 126857815
5-chloro-N-[(1R,2S)-2-fluorocyclopentyl]pyrimidin-4-amine
CID 126987815
N-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine;hydrochloride
CID 175758651
3-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)piperidine-1-carboxylic acid
CID 118116183
N-[(3aS,6aR)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 155773580
N-(2-fluorocyclopentyl)-3-methylpyrazin-2-amine
CID 126856431
1-[2-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-8-azabicyclo[3.2.1]octan-8-yl]prop-2-en-1-one
CID 118115469
N-[(3R,5S)-5-methylpiperidin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 118115879
N-[1-(2-methylpropyl)piperidin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 136522620
(5R,6R)-1-methyl-6-(2-methylpyrazol-3-yl)-5-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)piperidin-2-one
CID 167804171
N-[(3R,4R)-4-methyl-1-[2-(methylamino)ethylsulfonyl]piperidin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 150410302

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine (CID 126857850) is N-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine is FC1CCCC1Nc1ncnc2[nH]ccc12.
What is the InChIKey of N-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine?
The InChIKey is DSFAZAMXEWEMEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN4/c12-8-2-1-3-9(8)16-11-7-4-5-13-10(7)14-6-15-11/h4-6,8-9H,1-3H2,(H2,13,14,15,16).
What are the key properties of N-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine?
N-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine has a molecular weight of 220.25 g/mol, XLogP of 2.26, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorocyclopentyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 126857850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).