N,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine

C16H27N3 — CID 79866723

IUPACN,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine
SMILESCNC1C(CN(C)Cc2cccnc2)CCC1(C)C
InChIInChI=1S/C16H27N3/c1-16(2)8-7-14(15(16)17-3)12-19(4)11-13-6-5-9-18-10-13/h5-6,9-10,14-15,17H,7-8,11-12H2,1-4H3
InChIKeyIFCLTWCZYJPDFJ-UHFFFAOYSA-N
MW261.41 g/mol
LogP2.54
Rot. Bonds5

About N,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine

N,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine (PubChem CID 79866723) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is N,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine.

Molecular Properties

Compound NameN,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine
PubChem CID79866723
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC NameN,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine
SMILESCNC1C(CN(C)Cc2cccnc2)CCC1(C)C
InChIInChI=1S/C16H27N3/c1-16(2)8-7-14(15(16)17-3)12-19(4)11-13-6-5-9-18-10-13/h5-6,9-10,14-15,17H,7-8,11-12H2,1-4H3
InChIKeyIFCLTWCZYJPDFJ-UHFFFAOYSA-N
XLogP2.54
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,2,2-trimethyl-6-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 79852306
N-ethyl-2,2-dimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine
CID 79866959
N-ethyl-2,2-dimethyl-6-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 79842445
5-[[(3-fluorophenyl)methyl-methylamino]methyl]-N,2,2-trimethylcyclopentan-1-amine
CID 79866448
N,2,2-trimethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]cyclopentan-1-amine
CID 79866875
N,2,2-trimethyl-5-[[methyl(2-phenylethyl)amino]methyl]cyclopentan-1-amine
CID 79855039
5-[[(5-bromothiophen-3-yl)methyl-methylamino]methyl]-N,2,2-trimethylcyclopentan-1-amine
CID 79866037
4-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 54928175
N-ethyl-5-[[(4-fluorophenyl)methyl-methylamino]methyl]-2,2-dimethylcyclopentan-1-amine
CID 79866407
2-[[methyl(pyridin-3-ylmethyl)amino]methyl]-N-propylcyclohexan-1-amine
CID 62615844
N-ethyl-2,2-dimethyl-6-[[methyl(pyridin-4-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 79842615
1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl-methylamino]-2-methylpropan-2-ol
CID 79856035

Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine?
The IUPAC name of N,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine (CID 79866723) is N,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine.
What is the SMILES notation for N,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine?
The canonical SMILES for N,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine is CNC1C(CN(C)Cc2cccnc2)CCC1(C)C.
What is the InChIKey of N,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine?
The InChIKey is IFCLTWCZYJPDFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-16(2)8-7-14(15(16)17-3)12-19(4)11-13-6-5-9-18-10-13/h5-6,9-10,14-15,17H,7-8,11-12H2,1-4H3.
What are the key properties of N,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine?
N,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine has a molecular weight of 261.41 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-5-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclopentan-1-amine is sourced from PubChem (CID 79866723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).