N-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine

C11H22N2 — CID 114430809

IUPACN-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine
SMILESCCC1CCNC(CNC2CC2)C1
InChIInChI=1S/C11H22N2/c1-2-9-5-6-12-11(7-9)8-13-10-3-4-10/h9-13H,2-8H2,1H3
InChIKeyXFWNZMLDWDHAOD-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.52
Rot. Bonds4

About N-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine

N-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine (PubChem CID 114430809) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is N-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine
PubChem CID114430809
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC NameN-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine
SMILESCCC1CCNC(CNC2CC2)C1
InChIInChI=1S/C11H22N2/c1-2-9-5-6-12-11(7-9)8-13-10-3-4-10/h9-13H,2-8H2,1H3
InChIKeyXFWNZMLDWDHAOD-UHFFFAOYSA-N
XLogP1.52
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-ethylpiperidin-2-yl)methyl]-2-methylpropan-1-amine
CID 114430810
N-[(4-ethylpiperidin-2-yl)methyl]-1-methylcyclopentan-1-amine
CID 114431221
N-[(4-ethylpiperidin-2-yl)methyl]-1-(oxolan-3-yl)methanamine
CID 114431077
N-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine
CID 114431402
4-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclohexan-1-amine
CID 55192738
1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-[(4-ethylpiperidin-2-yl)methyl]ethanamine
CID 114430915
1-(4-ethylpiperidin-2-yl)-3,3-dimethylbutan-2-ol
CID 114426002
1-(4-ethylpiperidin-2-yl)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]methanamine
CID 114113000
methyl 3-(4-ethylpiperidin-2-yl)-2-oxopropanoate
CID 114425893
1-(4-ethylpiperidin-2-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine
CID 114431418
4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106638181
N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine
CID 130921273

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine?
The IUPAC name of N-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine (CID 114430809) is N-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine?
The canonical SMILES for N-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine is CCC1CCNC(CNC2CC2)C1.
What is the InChIKey of N-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine?
The InChIKey is XFWNZMLDWDHAOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-2-9-5-6-12-11(7-9)8-13-10-3-4-10/h9-13H,2-8H2,1H3.
What are the key properties of N-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine?
N-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine has a molecular weight of 182.31 g/mol, XLogP of 1.52, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine is sourced from PubChem (CID 114430809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).