N-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine

C14H20N2O — CID 142371475

IUPACN-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine
SMILESCc1ncc([C@@H]2CCOC2)cc1NC1CCC1
InChIInChI=1S/C14H20N2O/c1-10-14(16-13-3-2-4-13)7-12(8-15-10)11-5-6-17-9-11/h7-8,11,13,16H,2-6,9H2,1H3/t11-/m1/s1
InChIKeyPQELPWGJDIBALI-LLVKDONJSA-N
MW232.33 g/mol
LogP2.86
Rot. Bonds3

About N-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine

N-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine (PubChem CID 142371475) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine.

Molecular Properties

Compound NameN-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine
PubChem CID142371475
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine
SMILESCc1ncc([C@@H]2CCOC2)cc1NC1CCC1
InChIInChI=1S/C14H20N2O/c1-10-14(16-13-3-2-4-13)7-12(8-15-10)11-5-6-17-9-11/h7-8,11,13,16H,2-6,9H2,1H3/t11-/m1/s1
InChIKeyPQELPWGJDIBALI-LLVKDONJSA-N
XLogP2.86
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(Oxolan-3-yl)-1-(pyridin-3-yl)ethan-1-amine
CID 22992279
6-(Oxan-4-yl)pyridin-3-amine
CID 86692451
2-{4-[(Cyclopropylmethoxy)methyl]pyrrolidin-3-YL}pyridine
CID 110203401
Sdccgsbi-0115100.P001
CID 45229717
1-(Oxolan-2-yl)-1-(pyridin-3-yl)methanamine dihydrochloride
CID 155973476
1-(Oxolan-3-yl)-1-(pyridin-3-yl)methanamine dihydrochloride
CID 155977801
3-(Oxolan-3-yl)-1-(pyridin-3-yl)propan-1-amine dihydrochloride
CID 165946628
2-[4-(Methoxymethyl)pyrrolidin-3-YL]pyridine
CID 124051514
1-(5-ethyl-2-pyridinyl)-N-[[(3R)-3-(3-fluorophenyl)oxolan-3-yl]methyl]methanamine
CID 28133898
5-[1-(Oxan-3-yl)ethylamino]pyridine-2-carbonitrile
CID 86785465
(1S)-N-[2-(6-methyl-3-pyridinyl)ethyl]-1-(oxan-4-yl)ethanamine
CID 97788834
3-[(3R,4S)-3,4-dimethyloxolan-3-yl]-4-fluoro-N-[1-[5-(trifluoromethyl)-2-pyridinyl]ethenyl]aniline
CID 90253235

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine?
The IUPAC name of N-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine (CID 142371475) is N-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine.
What is the SMILES notation for N-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine?
The canonical SMILES for N-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine is Cc1ncc([C@@H]2CCOC2)cc1NC1CCC1.
What is the InChIKey of N-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine?
The InChIKey is PQELPWGJDIBALI-LLVKDONJSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10-14(16-13-3-2-4-13)7-12(8-15-10)11-5-6-17-9-11/h7-8,11,13,16H,2-6,9H2,1H3/t11-/m1/s1.
What are the key properties of N-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine?
N-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine has a molecular weight of 232.33 g/mol, XLogP of 2.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-2-methyl-5-[(3S)-oxolan-3-yl]pyridin-3-amine is sourced from PubChem (CID 142371475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).