N-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine

C11H22N2O — CID 65365085

IUPACN-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine
SMILESCOCN1CCCC(CNC2CC2)C1
InChIInChI=1S/C11H22N2O/c1-14-9-13-6-2-3-10(8-13)7-12-11-4-5-11/h10-12H,2-9H2,1H3
InChIKeyKZQRCZKSXSTDCQ-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.05
Rot. Bonds5

About N-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine

N-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine (PubChem CID 65365085) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine
PubChem CID65365085
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine
SMILESCOCN1CCCC(CNC2CC2)C1
InChIInChI=1S/C11H22N2O/c1-14-9-13-6-2-3-10(8-13)7-12-11-4-5-11/h10-12H,2-9H2,1H3
InChIKeyKZQRCZKSXSTDCQ-UHFFFAOYSA-N
XLogP1.05
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-[2-(3-methoxypropoxy)ethyl]piperidin-3-yl]methyl]cyclopropanamine
CID 103180319
N-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride
CID 115597495
methyl 3-[3-[(cyclopropylamino)methyl]piperidin-1-yl]-2,2-dimethylpropanoate
CID 79631848
N-[[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methyl]cyclopropanamine
CID 62580078
4-[3-[(cyclopropylamino)methyl]piperidin-1-yl]-2-methylbutan-2-ol
CID 79354897
N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 106589270
3-[3-[(cyclopropylamino)methyl]piperidin-1-yl]-2,2-dimethylpropanoic acid
CID 79630442
N-[[1-[2-(1-methylpiperidin-2-yl)ethyl]piperidin-3-yl]methyl]cyclopropanamine
CID 107912652
N-(cyclopentylmethyl)-1-ethylazepan-4-amine
CID 65074491
N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopropanamine
CID 62582229
N-[[1-(2-phenoxyethyl)piperidin-3-yl]methyl]cyclopropanamine
CID 62580428
N-butan-2-yl-2-[3-[(cyclopropylamino)methyl]piperidin-1-yl]acetamide
CID 63847790

Frequently Asked Questions

What is the IUPAC name of N-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine (CID 65365085) is N-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine is COCN1CCCC(CNC2CC2)C1.
What is the InChIKey of N-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine?
The InChIKey is KZQRCZKSXSTDCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-14-9-13-6-2-3-10(8-13)7-12-11-4-5-11/h10-12H,2-9H2,1H3.
What are the key properties of N-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine?
N-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine has a molecular weight of 198.31 g/mol, XLogP of 1.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine is sourced from PubChem (CID 65365085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).