2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine

C16H26N2O — CID 79860528

IUPAC2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine
SMILESCC(C)Oc1ncccc1CNC1CCCC1(C)C
InChIInChI=1S/C16H26N2O/c1-12(2)19-15-13(7-6-10-17-15)11-18-14-8-5-9-16(14,3)4/h6-7,10,12,14,18H,5,8-9,11H2,1-4H3
InChIKeyDTUVOFITFAPFIC-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.54
Rot. Bonds5

About 2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine

2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine (PubChem CID 79860528) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine
PubChem CID79860528
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine
SMILESCC(C)Oc1ncccc1CNC1CCCC1(C)C
InChIInChI=1S/C16H26N2O/c1-12(2)19-15-13(7-6-10-17-15)11-18-14-8-5-9-16(14,3)4/h6-7,10,12,14,18H,5,8-9,11H2,1-4H3
InChIKeyDTUVOFITFAPFIC-UHFFFAOYSA-N
XLogP3.54
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine with MolForge

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Launch Full Analysis

Related Compounds

N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopropanamine
CID 62290526
2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol
CID 61374613
4-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclohexan-1-amine
CID 61373850
3-propan-2-yl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclobutan-1-amine
CID 103561785
4-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclohexane-1,4-diamine
CID 79741488
3-[[(2,2-dimethylcyclohexyl)amino]methyl]pyridine-2-carbonitrile
CID 79871903
2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cycloheptane-1-carbonitrile
CID 62742241
5,5-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]thian-3-amine
CID 79958638
N-[[2-(methoxymethyl)phenyl]methyl]-2,2-dimethylcyclopentan-1-amine
CID 79860027
1-methyl-3-[(2-propan-2-yloxy-3-pyridinyl)methylamino]pyrrolidine-2,5-dione
CID 61375350
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine
CID 61373670
5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]thiolan-3-amine
CID 79950310

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine?
The IUPAC name of 2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine (CID 79860528) is 2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine?
The canonical SMILES for 2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine is CC(C)Oc1ncccc1CNC1CCCC1(C)C.
What is the InChIKey of 2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine?
The InChIKey is DTUVOFITFAPFIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-12(2)19-15-13(7-6-10-17-15)11-18-14-8-5-9-16(14,3)4/h6-7,10,12,14,18H,5,8-9,11H2,1-4H3.
What are the key properties of 2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine?
2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine has a molecular weight of 262.40 g/mol, XLogP of 3.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 79860528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).