4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine

C17H25N3O — CID 62287774

IUPAC4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine
SMILESCCN(Cc1ccco1)c1cc(CNC(C)(C)C)ccn1
InChIInChI=1S/C17H25N3O/c1-5-20(13-15-7-6-10-21-15)16-11-14(8-9-18-16)12-19-17(2,3)4/h6-11,19H,5,12-13H2,1-4H3
InChIKeyHUEQJZXUVIETRC-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.59
Rot. Bonds6

About 4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine

4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine (PubChem CID 62287774) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is 4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound Name4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine
PubChem CID62287774
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine
SMILESCCN(Cc1ccco1)c1cc(CNC(C)(C)C)ccn1
InChIInChI=1S/C17H25N3O/c1-5-20(13-15-7-6-10-21-15)16-11-14(8-9-18-16)12-19-17(2,3)4/h6-11,19H,5,12-13H2,1-4H3
InChIKeyHUEQJZXUVIETRC-UHFFFAOYSA-N
XLogP3.59
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)aniline
CID 63060085
2-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-4-amine
CID 62288315
4-[(tert-butylamino)methyl]-N-ethyl-N-(2-methoxyethyl)pyridin-2-amine
CID 62293920
N-ethyl-6-fluoro-N-(furan-2-ylmethyl)pyrimidin-4-amine
CID 115416612
N-ethyl-N-(furan-2-ylmethyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine
CID 107379760
4-[(tert-butylamino)methyl]-N,N-bis(2-methoxyethyl)pyridin-2-amine
CID 62289206
N-[[4-[(tert-butylamino)methyl]furan-2-yl]methyl]-N-ethylaniline
CID 62424681
N-ethyl-N-(furan-2-ylmethyl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 62288133
N-butan-2-yl-4-[(tert-butylamino)methyl]-N-methylpyridin-2-amine
CID 62279317
5-amino-2-[ethyl(furan-2-ylmethyl)amino]pyridine-4-carboxylic acid
CID 114090156
4-N-ethyl-4-N-(furan-2-ylmethyl)-2-N-methyl-6-(trifluoromethyl)pyrimidine-2,4-diamine
CID 114564325
4-N-ethyl-4-N-(furan-2-ylmethyl)-2-methyl-6-N-propylpyrimidine-4,6-diamine
CID 80796536

Frequently Asked Questions

What is the IUPAC name of 4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine?
The IUPAC name of 4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine (CID 62287774) is 4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine.
What is the SMILES notation for 4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine?
The canonical SMILES for 4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine is CCN(Cc1ccco1)c1cc(CNC(C)(C)C)ccn1.
What is the InChIKey of 4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine?
The InChIKey is HUEQJZXUVIETRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-5-20(13-15-7-6-10-21-15)16-11-14(8-9-18-16)12-19-17(2,3)4/h6-11,19H,5,12-13H2,1-4H3.
What are the key properties of 4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine?
4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine has a molecular weight of 287.41 g/mol, XLogP of 3.59, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 62287774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).