4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine

C14H23N3 — CID 105072864

IUPAC4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine
SMILESCN(c1cnccc1CNC(C)(C)C)C1CC1
InChIInChI=1S/C14H23N3/c1-14(2,3)16-9-11-7-8-15-10-13(11)17(4)12-5-6-12/h7-8,10,12,16H,5-6,9H2,1-4H3
InChIKeySPSJMLKQRGODJR-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.57
Rot. Bonds4

About 4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine

4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine (PubChem CID 105072864) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine.

Molecular Properties

Compound Name4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine
PubChem CID105072864
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine
SMILESCN(c1cnccc1CNC(C)(C)C)C1CC1
InChIInChI=1S/C14H23N3/c1-14(2,3)16-9-11-7-8-15-10-13(11)17(4)12-5-6-12/h7-8,10,12,16H,5-6,9H2,1-4H3
InChIKeySPSJMLKQRGODJR-UHFFFAOYSA-N
XLogP2.57
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(tert-butylamino)methyl]-N-cyclohexyl-N-methylpyridin-4-amine
CID 81249277
4-[(tert-butylamino)methyl]-N-cyclopentyl-N-ethylpyridin-3-amine
CID 105072970
N-cyclobutyl-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-3-amine
CID 105074523
[3-[cyclopropyl(methyl)amino]-4-pyridinyl]methanol
CID 105066695
N-cyclobutyl-4-(ethylaminomethyl)-N-methylpyridin-3-amine
CID 105074525
N-methyl-N-(4-methylcyclohexyl)-4-[(propan-2-ylamino)methyl]pyridin-3-amine
CID 105073614
4-[(tert-butylamino)methyl]-N-(cyclopropylmethyl)-N-ethylpyridin-3-amine
CID 105073982
3-[(tert-butylamino)methyl]-N-methyl-N-(oxolan-3-yl)pyridin-4-amine
CID 82754061
4-[(tert-butylamino)methyl]-N-methyl-N-(2-methylbutyl)pyridin-3-amine
CID 105072928
N-(4-ethylcyclohexyl)-N-methyl-4-(propylaminomethyl)pyridin-3-amine
CID 105073619
N'-[4-[(tert-butylamino)methyl]-3-pyridinyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 105073949
4-(ethylaminomethyl)-N-methyl-N-(oxan-4-yl)pyridin-3-amine
CID 105073064

Frequently Asked Questions

What is the IUPAC name of 4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine?
The IUPAC name of 4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine (CID 105072864) is 4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine.
What is the SMILES notation for 4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine?
The canonical SMILES for 4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine is CN(c1cnccc1CNC(C)(C)C)C1CC1.
What is the InChIKey of 4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine?
The InChIKey is SPSJMLKQRGODJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-14(2,3)16-9-11-7-8-15-10-13(11)17(4)12-5-6-12/h7-8,10,12,16H,5-6,9H2,1-4H3.
What are the key properties of 4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine?
4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine has a molecular weight of 233.36 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(tert-butylamino)methyl]-N-cyclopropyl-N-methylpyridin-3-amine is sourced from PubChem (CID 105072864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).