3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine

C14H25N3 — CID 81246316

IUPAC3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine
SMILESCNCc1cnccc1N(CC(C)C)C(C)C
InChIInChI=1S/C14H25N3/c1-11(2)10-17(12(3)4)14-6-7-16-9-13(14)8-15-5/h6-7,9,11-12,15H,8,10H2,1-5H3
InChIKeyQDDYXQWYOSMSHN-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.67
Rot. Bonds6

About 3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine

3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine (PubChem CID 81246316) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is 3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine.

Molecular Properties

Compound Name3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine
PubChem CID81246316
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC Name3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine
SMILESCNCc1cnccc1N(CC(C)C)C(C)C
InChIInChI=1S/C14H25N3/c1-11(2)10-17(12(3)4)14-6-7-16-9-13(14)8-15-5/h6-7,9,11-12,15H,8,10H2,1-5H3
InChIKeyQDDYXQWYOSMSHN-UHFFFAOYSA-N
XLogP2.67
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(methylaminomethyl)-N-(2-methylpropyl)-N-pentan-3-ylpyridin-3-amine
CID 105074176
N-(2-methylpropyl)-N-pentan-3-yl-3-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 81254476
N-cyclopentyl-3-(methylaminomethyl)-N-(3-methylbutyl)pyridin-4-amine
CID 81247339
N-methyl-4-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine
CID 105072723
3-[(cyclopropylamino)methyl]-N-ethyl-N-propan-2-ylpyridin-4-amine
CID 81249309
N-cycloheptyl-N-methyl-3-(methylaminomethyl)pyridin-4-amine
CID 81247152
N-cyclohexyl-N-methyl-3-(methylaminomethyl)pyridin-4-amine
CID 81249487
2-N-ethyl-2-N-[3-(ethylaminomethyl)-4-pyridinyl]-1-N,1-N-dimethylpropane-1,2-diamine
CID 103191478
3-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine
CID 81248637
3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-propan-2-ylpyridin-4-amine
CID 82953192
N-methyl-1-(4-methyl-3-pyridinyl)methanamine;dihydrochloride
CID 171316354
N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-4-amine
CID 81246811

Frequently Asked Questions

What is the IUPAC name of 3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine?
The IUPAC name of 3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine (CID 81246316) is 3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine.
What is the SMILES notation for 3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine?
The canonical SMILES for 3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine is CNCc1cnccc1N(CC(C)C)C(C)C.
What is the InChIKey of 3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine?
The InChIKey is QDDYXQWYOSMSHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-11(2)10-17(12(3)4)14-6-7-16-9-13(14)8-15-5/h6-7,9,11-12,15H,8,10H2,1-5H3.
What are the key properties of 3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine?
3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine has a molecular weight of 235.37 g/mol, XLogP of 2.67, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylpyridin-4-amine is sourced from PubChem (CID 81246316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).