(R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine

C10H13ClN2 — CID 131061254

IUPAC(R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine
SMILESN[C@@H](c1cccnc1Cl)C1CCC1
InChIInChI=1S/C10H13ClN2/c11-10-8(5-2-6-13-10)9(12)7-3-1-4-7/h2,5-7,9H,1,3-4,12H2/t9-/m1/s1
InChIKeyLSFBOOZDGBETCT-SECBINFHSA-N
MW196.68 g/mol
LogP2.53
Rot. Bonds2

About (R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine

(R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine (PubChem CID 131061254) has the molecular formula C10H13ClN2 and a molecular weight of 196.68 g/mol. Its IUPAC name is (R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine.

Molecular Properties

Compound Name(R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine
PubChem CID131061254
Molecular FormulaC10H13ClN2
Molecular Weight196.68 g/mol
Exact Mass196.08
IUPAC Name(R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine
SMILESN[C@@H](c1cccnc1Cl)C1CCC1
InChIInChI=1S/C10H13ClN2/c11-10-8(5-2-6-13-10)9(12)7-3-1-4-7/h2,5-7,9H,1,3-4,12H2/t9-/m1/s1
InChIKeyLSFBOOZDGBETCT-SECBINFHSA-N
XLogP2.53
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.68
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(R)-(2-chloro-3-pyridinyl)-(oxan-4-yl)methanamine;hydrochloride
CID 171245874
(R)-cyclopentyl-(2-fluoro-3-pyridinyl)methanamine
CID 130632989
3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride
CID 171211332
(R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine
CID 124518533
N-[1-(2-chloro-3-pyridinyl)ethyl]-1-cyclobutylethanamine
CID 115896481
(R)-(2-chlorophenyl)-cyclopentylmethanamine
CID 91256846
(R)-(3-chloro-4-pyridinyl)-cyclobutylmethanamine
CID 130633063
(S)-(3-bromo-2-chlorophenyl)-cyclobutylmethanamine
CID 130612686
(1S)-1-(2-chloro-3-pyridinyl)-2-methylpropan-1-amine
CID 130649369
cyclopropyl-(2-ethoxy-3-pyridinyl)methanamine
CID 55296468
1-[(R)-(2-chloro-3-pyridinyl)-cyclohexylmethyl]piperazine
CID 171285765
1-[(S)-(2-chloro-3-pyridinyl)-cyclohexylmethyl]piperazine
CID 171273137

Frequently Asked Questions

What is the IUPAC name of (R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine?
The IUPAC name of (R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine (CID 131061254) is (R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine.
What is the SMILES notation for (R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine?
The canonical SMILES for (R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine is N[C@@H](c1cccnc1Cl)C1CCC1.
What is the InChIKey of (R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine?
The InChIKey is LSFBOOZDGBETCT-SECBINFHSA-N. The full InChI is InChI=1S/C10H13ClN2/c11-10-8(5-2-6-13-10)9(12)7-3-1-4-7/h2,5-7,9H,1,3-4,12H2/t9-/m1/s1.
What are the key properties of (R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine?
(R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine has a molecular weight of 196.68 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine is sourced from PubChem (CID 131061254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).