2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine

C14H21N5O — CID 106597832

IUPAC2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine
SMILESCc1cc(CNC(C)(C)C)cc(Oc2ncn(C)n2)n1
InChIInChI=1S/C14H21N5O/c1-10-6-11(8-16-14(2,3)4)7-12(17-10)20-13-15-9-19(5)18-13/h6-7,9,16H,8H2,1-5H3
InChIKeyLBMOXHPRHBGUDU-UHFFFAOYSA-N
MW275.36 g/mol
LogP2.20
Rot. Bonds4

About 2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine

2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine (PubChem CID 106597832) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is 2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine
PubChem CID106597832
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine
SMILESCc1cc(CNC(C)(C)C)cc(Oc2ncn(C)n2)n1
InChIInChI=1S/C14H21N5O/c1-10-6-11(8-16-14(2,3)4)7-12(17-10)20-13-15-9-19(5)18-13/h6-7,9,16H,8H2,1-5H3
InChIKeyLBMOXHPRHBGUDU-UHFFFAOYSA-N
XLogP2.20
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine with MolForge

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Related Compounds

N-[[4,6-dimethyl-2-[(1-methyl-1,2,4-triazol-3-yl)oxy]-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 106597923
N-[[3-chloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 106597989
N-[[2-(1-ethylpyrazol-4-yl)oxy-6-methyl-4-pyridinyl]methyl]-2-methylpropan-2-amine
CID 116802838
[2-tert-butyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methanol
CID 106597594
4-bromo-2-tert-butyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]pyrimidine
CID 106597003
2-methyl-N-[[2-[(1-methyl-1,2,4-triazol-3-yl)oxy]-3-pyridinyl]methyl]propan-2-amine
CID 106597925
N-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774851
2-methyl-N-[(1-methyl-1,2,4-triazol-3-yl)methyl]propan-2-amine
CID 59539259
[6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-(trifluoromethyl)pyrimidin-4-yl]hydrazine
CID 106776501
N-methyl-1-[6-methyl-4-[(1-methyl-1,2,4-triazol-3-yl)oxy]-3-pyridinyl]methanamine
CID 106597823
2-cyclopropyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-N-propylpyrimidin-4-amine
CID 106598687
6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-N-propylpyrimidin-4-amine
CID 106598602

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine (CID 106597832) is 2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine is Cc1cc(CNC(C)(C)C)cc(Oc2ncn(C)n2)n1.
What is the InChIKey of 2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine?
The InChIKey is LBMOXHPRHBGUDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-10-6-11(8-16-14(2,3)4)7-12(17-10)20-13-15-9-19(5)18-13/h6-7,9,16H,8H2,1-5H3.
What are the key properties of 2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine?
2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine has a molecular weight of 275.36 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[2-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-4-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 106597832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).