5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine

C14H22N2O — CID 103932306

IUPAC5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine
SMILESCc1cncc(NC2CCOC(C(C)C)C2)c1
InChIInChI=1S/C14H22N2O/c1-10(2)14-7-12(4-5-17-14)16-13-6-11(3)8-15-9-13/h6,8-10,12,14,16H,4-5,7H2,1-3H3
InChIKeyAKLHCKUPVCLTLS-UHFFFAOYSA-N
MW234.34 g/mol
LogP3.01
Rot. Bonds3

About 5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine

5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine (PubChem CID 103932306) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine.

Molecular Properties

Compound Name5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine
PubChem CID103932306
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine
SMILESCc1cncc(NC2CCOC(C(C)C)C2)c1
InChIInChI=1S/C14H22N2O/c1-10(2)14-7-12(4-5-17-14)16-13-6-11(3)8-15-9-13/h6,8-10,12,14,16H,4-5,7H2,1-3H3
InChIKeyAKLHCKUPVCLTLS-UHFFFAOYSA-N
XLogP3.01
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-[(1R,2S)-2-(2-methoxyethyl)cyclopropyl]-3-pyridinyl]-1,4-diazepane
CID 134133420
1-[5-[(1S,2R)-2-(2-methoxyethyl)cyclopropyl]-3-pyridinyl]-1,4-diazepane
CID 134147102
(1S,4S)-2-[5-[(1R,2S)-2-(2-methoxyethyl)cyclopropyl]-3-pyridinyl]-2,5-diazabicyclo[2.2.1]heptane
CID 134134377
(1S,4S)-2-[5-[(1S,2R)-2-(2-methoxyethyl)cyclopropyl]-3-pyridinyl]-2,5-diazabicyclo[2.2.1]heptane
CID 134140902
6-(Oxan-4-yl)pyridin-3-amine
CID 86692451
2-(oxolan-2-yl)-N-(pyridin-3-ylmethyl)ethanamine
CID 44409947
3-Cyclohexyl-3-[(5-methyl-2-pyridinyl)methylamino]propan-1-ol
CID 84595291
N-[2-[4-(3-methyl-4-pyridinyl)cyclohexyl]ethyl]oxan-4-amine
CID 153032306
4-methyl-N-[2-[4-(3-methyl-2-pyridinyl)cyclohexyl]ethyl]oxan-4-amine
CID 153338584
N-[2-[4-(3-methyl-2-pyridinyl)cyclohexyl]ethyl]oxan-4-amine
CID 153338589
N-[2-[4-(4-methyl-3-pyridinyl)cyclohexyl]ethyl]oxan-4-amine
CID 155757720
3-(Oxolan-2-yl)-1-(pyridin-3-yl)propan-1-amine
CID 65167076

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine?
The IUPAC name of 5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine (CID 103932306) is 5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine.
What is the SMILES notation for 5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine?
The canonical SMILES for 5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine is Cc1cncc(NC2CCOC(C(C)C)C2)c1.
What is the InChIKey of 5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine?
The InChIKey is AKLHCKUPVCLTLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-10(2)14-7-12(4-5-17-14)16-13-6-11(3)8-15-9-13/h6,8-10,12,14,16H,4-5,7H2,1-3H3.
What are the key properties of 5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine?
5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine has a molecular weight of 234.34 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-propan-2-yloxan-4-yl)pyridin-3-amine is sourced from PubChem (CID 103932306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).