4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine

C9H14FN3 — CID 105388980

IUPAC4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine
SMILESCCN(C)c1nccc(CN)c1F
InChIInChI=1S/C9H14FN3/c1-3-13(2)9-8(10)7(6-11)4-5-12-9/h4-5H,3,6,11H2,1-2H3
InChIKeySMBHBIFTSLWIOX-UHFFFAOYSA-N
MW183.23 g/mol
LogP1.14
Rot. Bonds3

About 4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine

4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine (PubChem CID 105388980) has the molecular formula C9H14FN3 and a molecular weight of 183.23 g/mol. Its IUPAC name is 4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine
PubChem CID105388980
Molecular FormulaC9H14FN3
Molecular Weight183.23 g/mol
Exact Mass183.12
IUPAC Name4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine
SMILESCCN(C)c1nccc(CN)c1F
InChIInChI=1S/C9H14FN3/c1-3-13(2)9-8(10)7(6-11)4-5-12-9/h4-5H,3,6,11H2,1-2H3
InChIKeySMBHBIFTSLWIOX-UHFFFAOYSA-N
XLogP1.14
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.23
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(aminomethyl)-3-fluoro-N-methyl-N-(2-methylbutyl)pyridin-2-amine
CID 105389049
4-(aminomethyl)-3-fluoro-N-methyl-N-(2-methylsulfanylethyl)pyridin-2-amine
CID 105390306
4-(aminomethyl)-N-[(4-bromophenyl)methyl]-3-fluoro-N-methylpyridin-2-amine
CID 105389702
4-(aminomethyl)-3-fluoro-N-methyl-N-pent-4-enylpyridin-2-amine
CID 105390426
4-(aminomethyl)-N-ethyl-3-fluoro-N-prop-2-enylpyridin-2-amine
CID 105390237
4-(aminomethyl)-N-[(3-chlorophenyl)methyl]-3-fluoro-N-methylpyridin-2-amine
CID 105389320
4-(aminomethyl)-3-fluoro-N-(4-methoxyphenyl)-N-methylpyridin-2-amine
CID 105389449
4-(aminomethyl)-N,N-bis(2-ethoxyethyl)-3-fluoropyridin-2-amine
CID 105390289
4-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-3-fluoro-N-methylpyridin-2-amine
CID 105389498
4-(aminomethyl)-3-fluoro-N-(2-methylpropyl)-N-propan-2-ylpyridin-2-amine
CID 105389620
4-(chloromethyl)-3-fluoro-N-methyl-N-propylpyridin-2-amine
CID 105383465
4-(aminomethyl)-N-butyl-N-cyclopropyl-3-fluoropyridin-2-amine
CID 105389359

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine?
The IUPAC name of 4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine (CID 105388980) is 4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine.
What is the SMILES notation for 4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine?
The canonical SMILES for 4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine is CCN(C)c1nccc(CN)c1F.
What is the InChIKey of 4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine?
The InChIKey is SMBHBIFTSLWIOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14FN3/c1-3-13(2)9-8(10)7(6-11)4-5-12-9/h4-5H,3,6,11H2,1-2H3.
What are the key properties of 4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine?
4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine has a molecular weight of 183.23 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-ethyl-3-fluoro-N-methylpyridin-2-amine is sourced from PubChem (CID 105388980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).