N-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine

C13H18N2O — CID 103348488

IUPACN-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine
SMILESCOc1cccc(C2CC2CNC2CC2)n1
InChIInChI=1S/C13H18N2O/c1-16-13-4-2-3-12(15-13)11-7-9(11)8-14-10-5-6-10/h2-4,9-11,14H,5-8H2,1H3
InChIKeyXURZAAKYMNNLRQ-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.95
Rot. Bonds5

About N-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine

N-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine (PubChem CID 103348488) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is N-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine
PubChem CID103348488
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC NameN-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine
SMILESCOc1cccc(C2CC2CNC2CC2)n1
InChIInChI=1S/C13H18N2O/c1-16-13-4-2-3-12(15-13)11-7-9(11)8-14-10-5-6-10/h2-4,9-11,14H,5-8H2,1H3
InChIKeyXURZAAKYMNNLRQ-UHFFFAOYSA-N
XLogP1.95
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(6-methoxy-2-pyridinyl)-1-methylazepan-3-yl]methyl]cyclopropanamine
CID 103348585
5-ethyl-4-(6-methoxy-2-pyridinyl)pyrrolidin-2-one
CID 103348678
N-[[2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methyl]cyclopropanamine
CID 63992542
N-[[2-(6-methoxy-3-pyridinyl)oxan-3-yl]methyl]cyclopropanamine
CID 114938990
N-[[2-(4-methyl-1,3-thiazol-2-yl)cyclopropyl]methyl]cyclopropanamine
CID 104771669
5-benzyl-4-(6-methoxy-2-pyridinyl)pyrrolidin-2-one
CID 103348679
1-(6-methoxy-2-pyridinyl)-N-propylpiperidin-4-amine
CID 63588941
N-[[6-(3-methoxyphenoxy)-2-pyridinyl]methyl]cyclopropanamine
CID 62298332
N-[[2-(5-methylthiophen-2-yl)cyclopropyl]methyl]cyclopropanamine
CID 62713149
N-(3-ethylcyclohexyl)-6-methoxypyridin-2-amine
CID 64742812
2-(6-methoxy-2-pyridinyl)oxan-4-ol
CID 103348636
3-[(6-methoxy-2-pyridinyl)oxy]propan-1-amine
CID 63586658

Frequently Asked Questions

What is the IUPAC name of N-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine (CID 103348488) is N-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine is COc1cccc(C2CC2CNC2CC2)n1.
What is the InChIKey of N-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine?
The InChIKey is XURZAAKYMNNLRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-16-13-4-2-3-12(15-13)11-7-9(11)8-14-10-5-6-10/h2-4,9-11,14H,5-8H2,1H3.
What are the key properties of N-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine?
N-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine has a molecular weight of 218.30 g/mol, XLogP of 1.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(6-methoxy-2-pyridinyl)cyclopropyl]methyl]cyclopropanamine is sourced from PubChem (CID 103348488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).