N-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine

C13H17N3O — CID 81249323

IUPACN-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine
SMILESCNCc1cnccc1N(C)Cc1ccco1
InChIInChI=1S/C13H17N3O/c1-14-8-11-9-15-6-5-13(11)16(2)10-12-4-3-7-17-12/h3-7,9,14H,8,10H2,1-2H3
InChIKeyPTLNONADYPXHFE-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.03
Rot. Bonds5

About N-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine

N-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine (PubChem CID 81249323) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine
PubChem CID81249323
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC NameN-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine
SMILESCNCc1cnccc1N(C)Cc1ccco1
InChIInChI=1S/C13H17N3O/c1-14-8-11-9-15-6-5-13(11)16(2)10-12-4-3-7-17-12/h3-7,9,14H,8,10H2,1-2H3
InChIKeyPTLNONADYPXHFE-UHFFFAOYSA-N
XLogP2.03
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine
CID 81246986
N-[(3-chlorophenyl)methyl]-N-methyl-3-(methylaminomethyl)pyridin-4-amine
CID 81246803
N-cyclopropyl-N-(furan-2-ylmethyl)-3-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 81253260
N-ethyl-3-fluoro-N-(furan-2-ylmethyl)-4-(methylaminomethyl)pyridin-2-amine
CID 105389589
3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine
CID 81246316
3-(ethylaminomethyl)-N-methyl-N-[(2-methylphenyl)methyl]pyridin-4-amine
CID 81246615
N-cycloheptyl-N-methyl-3-(methylaminomethyl)pyridin-4-amine
CID 81247152
N-cyclohexyl-N-methyl-3-(methylaminomethyl)pyridin-4-amine
CID 81249487
3-(ethylaminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridin-2-amine
CID 55211030
N-[(2-bromophenyl)methyl]-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 81249514
N-cyclopropyl-3-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-4-amine
CID 81247478
5-amino-4-chloro-2-[furan-2-ylmethyl(methyl)amino]-N-(pyridin-3-ylmethyl)benzamide
CID 163489528

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine?
The IUPAC name of N-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine (CID 81249323) is N-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine?
The canonical SMILES for N-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine is CNCc1cnccc1N(C)Cc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine?
The InChIKey is PTLNONADYPXHFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c1-14-8-11-9-15-6-5-13(11)16(2)10-12-4-3-7-17-12/h3-7,9,14H,8,10H2,1-2H3.
What are the key properties of N-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine?
N-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine has a molecular weight of 231.30 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine is sourced from PubChem (CID 81249323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).