3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine

C13H23N3 — CID 115607162

IUPAC3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine
SMILESCN(C)c1ncccc1CNCC(C)(C)C
InChIInChI=1S/C13H23N3/c1-13(2,3)10-14-9-11-7-6-8-15-12(11)16(4)5/h6-8,14H,9-10H2,1-5H3
InChIKeyXDYXHLROECIKLW-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.28
Rot. Bonds4

About 3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine

3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine (PubChem CID 115607162) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine.

Molecular Properties

Compound Name3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine
PubChem CID115607162
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine
SMILESCN(C)c1ncccc1CNCC(C)(C)C
InChIInChI=1S/C13H23N3/c1-13(2,3)10-14-9-11-7-6-8-15-12(11)16(4)5/h6-8,14H,9-10H2,1-5H3
InChIKeyXDYXHLROECIKLW-UHFFFAOYSA-N
XLogP2.28
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[(1-tert-butylpyrazol-4-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine
CID 56814861
1-tert-butyl-3-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-methylguanidine;hydroiodide
CID 110964708
3-[[(4-methoxy-3,5-dimethylphenyl)methylamino]methyl]-N,N-dimethylpyridin-2-amine;hydrochloride
CID 47615971
3-[(4-ethylsulfonylanilino)methyl]-N,N-dimethylpyridin-2-amine
CID 100663511
N-[(3-fluoro-2-pyridinyl)methyl]-2,2-dimethylpropan-1-amine
CID 115757254
N-ethyl-N-methyl-3-(propylaminomethyl)pyridin-2-amine
CID 62280397
N,N-dimethyl-3-[[[5-(trifluoromethoxy)-2-pyridinyl]amino]methyl]pyridin-2-amine
CID 133489708
2-chloro-N-[[2-(dimethylamino)-3-pyridinyl]methyl]benzenesulfonamide
CID 39660340
N,N-dimethyl-3-[(oxan-4-ylamino)methyl]pyridin-2-amine
CID 29153314
1-benzyl-3-[[2-(dimethylamino)-3-pyridinyl]methyl]thiourea
CID 43076083
3-N-[(2-ethylphenyl)methyl]-2-N,2-N-dimethylpyridine-2,3-diamine
CID 55067063
3-[(tert-butylamino)methyl]-N,N-diethylpyridin-2-amine
CID 62285753

Frequently Asked Questions

What is the IUPAC name of 3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine?
The IUPAC name of 3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine (CID 115607162) is 3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine.
What is the SMILES notation for 3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine?
The canonical SMILES for 3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine is CN(C)c1ncccc1CNCC(C)(C)C.
What is the InChIKey of 3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine?
The InChIKey is XDYXHLROECIKLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-13(2,3)10-14-9-11-7-6-8-15-12(11)16(4)5/h6-8,14H,9-10H2,1-5H3.
What are the key properties of 3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine?
3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine has a molecular weight of 221.35 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,2-dimethylpropylamino)methyl]-N,N-dimethylpyridin-2-amine is sourced from PubChem (CID 115607162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).