3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine

C14H19N3O — CID 61176681

IUPAC3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine
SMILESCc1cc(C)c(CN)c(N(C)Cc2ccco2)n1
InChIInChI=1S/C14H19N3O/c1-10-7-11(2)16-14(13(10)8-15)17(3)9-12-5-4-6-18-12/h4-7H,8-9,15H2,1-3H3
InChIKeyHHCIYGIEEKNBAI-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.39
Rot. Bonds4

About 3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine

3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine (PubChem CID 61176681) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine
PubChem CID61176681
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine
SMILESCc1cc(C)c(CN)c(N(C)Cc2ccco2)n1
InChIInChI=1S/C14H19N3O/c1-10-7-11(2)16-14(13(10)8-15)17(3)9-12-5-4-6-18-12/h4-7H,8-9,15H2,1-3H3
InChIKeyHHCIYGIEEKNBAI-UHFFFAOYSA-N
XLogP2.39
TPSA55.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(aminomethyl)-N,4,6-trimethyl-N-[(2-methylfuran-3-yl)methyl]pyridin-2-amine
CID 61426321
3-(aminomethyl)-N-[(4-methoxyphenyl)methyl]-N,4,6-trimethylpyridin-2-amine
CID 61419922
3-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylisoquinolin-1-amine
CID 62299114
3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine
CID 65484864
4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine
CID 82237096
4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine
CID 107541586
2-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylquinolin-4-amine
CID 63374307
2-(aminomethyl)-N-(furan-2-ylmethyl)-N,6-dimethylaniline
CID 107105514
N-benzyl-3-(chloromethyl)-N,4,6-trimethylpyridin-2-amine
CID 61255946
3-(aminomethyl)-N-cyclopropyl-N-(furan-2-ylmethyl)-2,6-dimethylpyridin-4-amine
CID 81050858
3-(aminomethyl)-N,4,6-trimethyl-N-(2-methylsulfonylethyl)pyridin-2-amine
CID 79841926
6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine
CID 62301068

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine?
The IUPAC name of 3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine (CID 61176681) is 3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine.
What is the SMILES notation for 3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine?
The canonical SMILES for 3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine is Cc1cc(C)c(CN)c(N(C)Cc2ccco2)n1.
What is the InChIKey of 3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine?
The InChIKey is HHCIYGIEEKNBAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-10-7-11(2)16-14(13(10)8-15)17(3)9-12-5-4-6-18-12/h4-7H,8-9,15H2,1-3H3.
What are the key properties of 3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine?
3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine has a molecular weight of 245.33 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine is sourced from PubChem (CID 61176681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).