N-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine

C17H29N3 — CID 106906060

IUPACN-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine
SMILESCC(N(C)Cc1cccc(CNC2CC2)n1)C(C)(C)C
InChIInChI=1S/C17H29N3/c1-13(17(2,3)4)20(5)12-16-8-6-7-15(19-16)11-18-14-9-10-14/h6-8,13-14,18H,9-12H2,1-5H3
InChIKeyVWXDXQQTMNXSOC-UHFFFAOYSA-N
MW275.44 g/mol
LogP3.20
Rot. Bonds6

About N-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine

N-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine (PubChem CID 106906060) has the molecular formula C17H29N3 and a molecular weight of 275.44 g/mol. Its IUPAC name is N-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine
PubChem CID106906060
Molecular FormulaC17H29N3
Molecular Weight275.44 g/mol
Exact Mass275.24
IUPAC NameN-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine
SMILESCC(N(C)Cc1cccc(CNC2CC2)n1)C(C)(C)C
InChIInChI=1S/C17H29N3/c1-13(17(2,3)4)20(5)12-16-8-6-7-15(19-16)11-18-14-9-10-14/h6-8,13-14,18H,9-12H2,1-5H3
InChIKeyVWXDXQQTMNXSOC-UHFFFAOYSA-N
XLogP3.20
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine with MolForge

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Related Compounds

N-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine
CID 106907080
N-[[6-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine
CID 106906024
N-[(6-hydrazinyl-2-pyridinyl)methyl]-N,3,3-trimethylbutan-2-amine
CID 79242842
N-[[6-[[3-methoxypropyl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine
CID 106906493
6-[(cyclopropylamino)methyl]-N-(2-methoxypropyl)pyridin-2-amine
CID 102700710
N-[[6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]methyl]cyclopropanamine
CID 62291463
N-[[6-[[methyl-[(1-methylimidazol-2-yl)methyl]amino]methyl]-2-pyridinyl]methyl]cyclopropanamine
CID 106906508
N-[[6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-2-pyridinyl]methyl]cyclopropanamine
CID 106908631
2-N-[6-[(cyclopropylamino)methyl]-2-pyridinyl]-2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine
CID 103191474
6-[(cyclopropylamino)methyl]-N-(cyclopropylmethyl)-N-methylpyridin-2-amine
CID 62281585
6-[(cyclopropylamino)methyl]-N-methyl-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 62284157
N-[[6-(ethylaminomethyl)-2-pyridinyl]methyl]-N,3-dimethylbutan-2-amine
CID 106905884

Frequently Asked Questions

What is the IUPAC name of N-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine?
The IUPAC name of N-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine (CID 106906060) is N-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine is CC(N(C)Cc1cccc(CNC2CC2)n1)C(C)(C)C.
What is the InChIKey of N-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine?
The InChIKey is VWXDXQQTMNXSOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3/c1-13(17(2,3)4)20(5)12-16-8-6-7-15(19-16)11-18-14-9-10-14/h6-8,13-14,18H,9-12H2,1-5H3.
What are the key properties of N-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine?
N-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine has a molecular weight of 275.44 g/mol, XLogP of 3.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine is sourced from PubChem (CID 106906060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).