4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine

C15H26FN3 — CID 105384745

IUPAC4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine
SMILESCCCN(CC)c1nccc(CNC(C)(C)C)c1F
InChIInChI=1S/C15H26FN3/c1-6-10-19(7-2)14-13(16)12(8-9-17-14)11-18-15(3,4)5/h8-9,18H,6-7,10-11H2,1-5H3
InChIKeyOLKHZADSXYTAKK-UHFFFAOYSA-N
MW267.39 g/mol
LogP3.35
Rot. Bonds6

About 4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine

4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine (PubChem CID 105384745) has the molecular formula C15H26FN3 and a molecular weight of 267.39 g/mol. Its IUPAC name is 4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine.

Molecular Properties

Compound Name4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine
PubChem CID105384745
Molecular FormulaC15H26FN3
Molecular Weight267.39 g/mol
Exact Mass267.21
IUPAC Name4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine
SMILESCCCN(CC)c1nccc(CNC(C)(C)C)c1F
InChIInChI=1S/C15H26FN3/c1-6-10-19(7-2)14-13(16)12(8-9-17-14)11-18-15(3,4)5/h8-9,18H,6-7,10-11H2,1-5H3
InChIKeyOLKHZADSXYTAKK-UHFFFAOYSA-N
XLogP3.35
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.39
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(tert-butylamino)methyl]-3-fluoro-N-propan-2-yl-N-propylpyridin-2-amine
CID 105384781
N,N-diethyl-3-fluoro-4-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 105388745
4-[(tert-butylamino)methyl]-N-ethyl-3-methyl-N-propylaniline
CID 62135693
4-[(cyclopropylamino)methyl]-3-fluoro-N-propyl-N-(2,2,2-trifluoroethyl)pyridin-2-amine
CID 105389282
3-[(tert-butylamino)methyl]-N,N-diethylpyridin-2-amine
CID 62285753
3-[[4-[(tert-butylamino)methyl]-3-fluoro-2-pyridinyl]-cyclopropylamino]propanenitrile
CID 105385441
4-[(tert-butylamino)methyl]-3-fluoro-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridin-2-amine
CID 105386398
N-benzyl-N-ethyl-4-(ethylaminomethyl)-3-fluoropyridin-2-amine
CID 105388950
4-(chloromethyl)-N-ethyl-3-fluoro-N-(2-methoxyethyl)pyridin-2-amine
CID 105383537
[3-fluoro-2-[propyl(prop-2-ynyl)amino]-4-pyridinyl]methanol
CID 105383144
N-butyl-4-[(tert-butylamino)methyl]-N-ethylpyridin-3-amine
CID 105072707
4-[(tert-butylamino)methyl]-N-ethyl-N-propylaniline
CID 55147217

Frequently Asked Questions

What is the IUPAC name of 4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine?
The IUPAC name of 4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine (CID 105384745) is 4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine.
What is the SMILES notation for 4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine?
The canonical SMILES for 4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine is CCCN(CC)c1nccc(CNC(C)(C)C)c1F.
What is the InChIKey of 4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine?
The InChIKey is OLKHZADSXYTAKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26FN3/c1-6-10-19(7-2)14-13(16)12(8-9-17-14)11-18-15(3,4)5/h8-9,18H,6-7,10-11H2,1-5H3.
What are the key properties of 4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine?
4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine has a molecular weight of 267.39 g/mol, XLogP of 3.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(tert-butylamino)methyl]-N-ethyl-3-fluoro-N-propylpyridin-2-amine is sourced from PubChem (CID 105384745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).