(3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine

C10H12ClN5 — CID 170577438

IUPAC(3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine
SMILESN[C@@H]1CCN(c2n[nH]c3cc(Cl)ncc23)C1
InChIInChI=1S/C10H12ClN5/c11-9-3-8-7(4-13-9)10(15-14-8)16-2-1-6(12)5-16/h3-4,6H,1-2,5,12H2,(H,14,15)/t6-/m1/s1
InChIKeyUCCYDNMHYDWJFB-ZCFIWIBFSA-N
MW237.69 g/mol
LogP1.15
Rot. Bonds1

About (3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine

(3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine (PubChem CID 170577438) has the molecular formula C10H12ClN5 and a molecular weight of 237.69 g/mol. Its IUPAC name is (3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine.

Molecular Properties

Compound Name(3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine
PubChem CID170577438
Molecular FormulaC10H12ClN5
Molecular Weight237.69 g/mol
Exact Mass237.08
IUPAC Name(3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine
SMILESN[C@@H]1CCN(c2n[nH]c3cc(Cl)ncc23)C1
InChIInChI=1S/C10H12ClN5/c11-9-3-8-7(4-13-9)10(15-14-8)16-2-1-6(12)5-16/h3-4,6H,1-2,5,12H2,(H,14,15)/t6-/m1/s1
InChIKeyUCCYDNMHYDWJFB-ZCFIWIBFSA-N
XLogP1.15
TPSA70.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.69
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-chloro-3-[3-(ethylsulfonylmethyl)pyrrolidin-1-yl]-1H-pyrazolo[4,3-c]pyridine
CID 175991248
1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)-3-methylazetidin-3-ol
CID 170577005
1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)-4-methylpyrrolidin-3-amine;2,2,2-trifluoroacetic acid
CID 175955965
6-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-oxa-6-azaspiro[3.3]heptane
CID 170577040
1-(6-methyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-ol
CID 170577660
1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)-N,5-dimethylpyrrolidin-3-amine
CID 170576993
6-chloro-1H-pyrazolo[4,3-c]pyridin-3-amine
CID 76847146
(3S)-1-(5,6-dichloro-3-pyridinyl)pyrrolidin-3-amine
CID 130693092
(3R)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]pyrrolidin-3-amine
CID 68801517
(3S)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]pyrrolidin-3-amine;hydrochloride
CID 71643949
(3R)-1-(6-chloro-5-methyl-3-pyridinyl)pyrrolidin-3-amine
CID 131173225
7-(3-aminopyrrolidin-1-yl)-8-chloro-1-methylpyrido[4,3-d]pyrimidine-2,4-dione
CID 59074312

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine?
The IUPAC name of (3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine (CID 170577438) is (3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine.
What is the SMILES notation for (3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine?
The canonical SMILES for (3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine is N[C@@H]1CCN(c2n[nH]c3cc(Cl)ncc23)C1.
What is the InChIKey of (3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine?
The InChIKey is UCCYDNMHYDWJFB-ZCFIWIBFSA-N. The full InChI is InChI=1S/C10H12ClN5/c11-9-3-8-7(4-13-9)10(15-14-8)16-2-1-6(12)5-16/h3-4,6H,1-2,5,12H2,(H,14,15)/t6-/m1/s1.
What are the key properties of (3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine?
(3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine has a molecular weight of 237.69 g/mol, XLogP of 1.15, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(6-chloro-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidin-3-amine is sourced from PubChem (CID 170577438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).