[1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol

C11H16ClN3O — CID 62890471

IUPAC[1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol
SMILESNc1ccc(Cl)c(CN2CCCC2CO)n1
InChIInChI=1S/C11H16ClN3O/c12-9-3-4-11(13)14-10(9)6-15-5-1-2-8(15)7-16/h3-4,8,16H,1-2,5-7H2,(H2,13,14)
InChIKeyPGQJRGZVRDUKMB-UHFFFAOYSA-N
MW241.72 g/mol
LogP1.27
Rot. Bonds3

About [1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol

[1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol (PubChem CID 62890471) has the molecular formula C11H16ClN3O and a molecular weight of 241.72 g/mol. Its IUPAC name is [1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol
PubChem CID62890471
Molecular FormulaC11H16ClN3O
Molecular Weight241.72 g/mol
Exact Mass241.10
IUPAC Name[1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol
SMILESNc1ccc(Cl)c(CN2CCCC2CO)n1
InChIInChI=1S/C11H16ClN3O/c12-9-3-4-11(13)14-10(9)6-15-5-1-2-8(15)7-16/h3-4,8,16H,1-2,5-7H2,(H2,13,14)
InChIKeyPGQJRGZVRDUKMB-UHFFFAOYSA-N
XLogP1.27
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol with MolForge

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Related Compounds

[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]piperidin-2-yl]methanol
CID 62890632
6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-ylmethyl)-5-chloropyridin-2-amine
CID 82753252
[1-[(3-amino-4-chlorophenyl)methyl]pyrrolidin-2-yl]methanol
CID 61407185
[1-[(5-aminopyrazin-2-yl)methyl]pyrrolidin-2-yl]methanol
CID 103056039
1-[1-[(3,6-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine
CID 62885085
[1-[(6-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol
CID 79037926
[1-[(2,5-dichlorophenyl)methyl]pyrrolidin-2-yl]methanol
CID 65321311
1-[(3,6-dichloro-2-pyridinyl)methyl]-2-ethylazepane
CID 104689621
[1-[(6-chloro-3-pyridinyl)methyl]pyrrolidin-2-yl]methanol
CID 60582294
1-[(3,6-dichloro-2-pyridinyl)methyl]pyrrolidine-2-carboxamide
CID 62890575
[(2S)-1-(pyridin-4-ylmethyl)pyrrolidin-2-yl]methanol
CID 42127568
2-[[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-6-methylpyridin-3-ol
CID 103885778

Frequently Asked Questions

What is the IUPAC name of [1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol?
The IUPAC name of [1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol (CID 62890471) is [1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol?
The canonical SMILES for [1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol is Nc1ccc(Cl)c(CN2CCCC2CO)n1.
What is the InChIKey of [1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol?
The InChIKey is PGQJRGZVRDUKMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O/c12-9-3-4-11(13)14-10(9)6-15-5-1-2-8(15)7-16/h3-4,8,16H,1-2,5-7H2,(H2,13,14).
What are the key properties of [1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol?
[1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol has a molecular weight of 241.72 g/mol, XLogP of 1.27, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(6-amino-3-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol is sourced from PubChem (CID 62890471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).