7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine

C17H17N7 — CID 165369144

IUPAC7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine
SMILESNc1nc2cc(-c3ccn[nH]3)ccc2c2nc([C@@H]3CCNC3)[nH]c12
InChIInChI=1S/C17H17N7/c18-16-15-14(22-17(23-15)10-3-5-19-8-10)11-2-1-9(7-13(11)21-16)12-4-6-20-24-12/h1-2,4,6-7,10,19H,3,5,8H2,(H2,18,21)(H,20,24)(H,22,23)/t10-/m1/s1
InChIKeyICZRFYAVEZPDSY-SNVBAGLBSA-N
MW319.37 g/mol
LogP2.16
Rot. Bonds2

About 7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine

7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine (PubChem CID 165369144) has the molecular formula C17H17N7 and a molecular weight of 319.37 g/mol. Its IUPAC name is 7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine.

Molecular Properties

Compound Name7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine
PubChem CID165369144
Molecular FormulaC17H17N7
Molecular Weight319.37 g/mol
Exact Mass319.15
IUPAC Name7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine
SMILESNc1nc2cc(-c3ccn[nH]3)ccc2c2nc([C@@H]3CCNC3)[nH]c12
InChIInChI=1S/C17H17N7/c18-16-15-14(22-17(23-15)10-3-5-19-8-10)11-2-1-9(7-13(11)21-16)12-4-6-20-24-12/h1-2,4,6-7,10,19H,3,5,8H2,(H2,18,21)(H,20,24)(H,22,23)/t10-/m1/s1
InChIKeyICZRFYAVEZPDSY-SNVBAGLBSA-N
XLogP2.16
TPSA108.30 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.37
LogP ≤ 52.16
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

7-(1H-pyrazol-5-yl)-2-(pyrrolidin-3-ylmethyl)-3H-imidazo[4,5-c]quinolin-4-amine
CID 165369174
1-[3-[4-amino-7-(1H-pyrazol-5-yl)-3H-imidazo[4,5-c]quinolin-2-yl]pyrrolidin-1-yl]-2-methylpropan-1-one
CID 170313063
1-[(3R)-3-[4-amino-7-(1H-pyrazol-5-yl)-3H-imidazo[4,5-c]quinolin-2-yl]piperidin-1-yl]-3-methylbutan-1-one
CID 169316740
[(3S)-3-[4-amino-7-(1H-pyrazol-5-yl)-3H-imidazo[4,5-c]quinolin-2-yl]piperidin-1-yl]-[1-(trifluoromethyl)cyclopropyl]methanone
CID 169316737
1-[(3S)-3-[4-amino-7-(1H-pyrazol-5-yl)-3H-imidazo[4,5-c]quinolin-2-yl]piperidine-1-carbonyl]cyclopentane-1-carbonitrile
CID 169316689
3-[4-amino-7-(1H-pyrazol-5-yl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol
CID 138584377
7-(1H-pyrazol-5-yl)-4-N-[(3R)-pyrrolidin-3-yl]quinoline-2,4-diamine
CID 137417936
2-(ethylaminomethyl)-7-(1H-pyrazol-5-yl)-3H-imidazo[4,5-c]quinolin-4-amine;dihydrochloride
CID 156756381
1-[(2S)-2-[[4-amino-7-(1H-pyrazol-5-yl)-3H-imidazo[4,5-c]quinolin-2-yl]methyl]pyrrolidin-1-yl]-3-methoxypropan-1-one
CID 169316681
2-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine
CID 161291199
2-[(3-methylidenemorpholin-4-yl)methyl]-7-(1H-pyrazol-5-yl)-3H-imidazo[4,5-c]quinolin-4-amine;2-[(2-methylidenepiperidin-1-yl)methyl]-7-(1H-pyrazol-5-yl)-3H-imidazo[4,5-c]quinolin-4-amine
CID 160902821
tert-butyl (2R)-2-[[4-amino-7-(1H-pyrazol-5-yl)-3H-imidazo[4,5-c]quinolin-2-yl]methyl]pyrrolidine-1-carboxylate
CID 165369182

Frequently Asked Questions

What is the IUPAC name of 7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine?
The IUPAC name of 7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine (CID 165369144) is 7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine.
What is the SMILES notation for 7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine?
The canonical SMILES for 7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine is Nc1nc2cc(-c3ccn[nH]3)ccc2c2nc([C@@H]3CCNC3)[nH]c12.
What is the InChIKey of 7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine?
The InChIKey is ICZRFYAVEZPDSY-SNVBAGLBSA-N. The full InChI is InChI=1S/C17H17N7/c18-16-15-14(22-17(23-15)10-3-5-19-8-10)11-2-1-9(7-13(11)21-16)12-4-6-20-24-12/h1-2,4,6-7,10,19H,3,5,8H2,(H2,18,21)(H,20,24)(H,22,23)/t10-/m1/s1.
What are the key properties of 7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine?
7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine has a molecular weight of 319.37 g/mol, XLogP of 2.16, 2 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1H-pyrazol-5-yl)-2-[(3R)-pyrrolidin-3-yl]-3H-imidazo[4,5-c]quinolin-4-amine is sourced from PubChem (CID 165369144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).