N-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine

C13H26N2 — CID 60867302

IUPACN-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine
SMILESCCC1CCCN(CCCNC2CC2)C1
InChIInChI=1S/C13H26N2/c1-2-12-5-3-9-15(11-12)10-4-8-14-13-6-7-13/h12-14H,2-11H2,1H3
InChIKeyYSDMFQMZNNZPHB-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.25
Rot. Bonds6

About N-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine

N-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine (PubChem CID 60867302) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine.

Molecular Properties

Compound NameN-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine
PubChem CID60867302
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine
SMILESCCC1CCCN(CCCNC2CC2)C1
InChIInChI=1S/C13H26N2/c1-2-12-5-3-9-15(11-12)10-4-8-14-13-6-7-13/h12-14H,2-11H2,1H3
InChIKeyYSDMFQMZNNZPHB-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(3-ethylpiperidin-1-yl)ethyl]-4-methylcyclohexan-1-amine
CID 55090197
4-ethyl-N-(3-pyrrolidin-1-ylpropyl)cyclohexan-1-amine
CID 28657772
N-[3-(3-ethylpiperidin-1-yl)propyl]-2-methylpropan-2-amine
CID 60851535
N-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine
CID 55087537
3-ethyl-1-heptylpiperidine
CID 171569576
N-[4-(4-ethylpiperidin-1-yl)butyl]cyclopropanamine
CID 62412900
N-[2-(3-ethylpiperidin-1-yl)ethyl]butan-1-amine
CID 62560238
3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide
CID 115608712
2-[(3R)-3-ethylpiperidin-1-yl]ethanamine
CID 93187820
N-[3-(3-propoxypiperidin-1-yl)propyl]cyclopentanamine
CID 62563284
6-(3-ethylpiperidin-1-yl)hexan-3-ol
CID 106802295
3-(3-ethylpiperidin-1-yl)propyl-trimethoxysilane
CID 19900960

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine?
The IUPAC name of N-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine (CID 60867302) is N-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine.
What is the SMILES notation for N-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine?
The canonical SMILES for N-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine is CCC1CCCN(CCCNC2CC2)C1.
What is the InChIKey of N-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine?
The InChIKey is YSDMFQMZNNZPHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-2-12-5-3-9-15(11-12)10-4-8-14-13-6-7-13/h12-14H,2-11H2,1H3.
What are the key properties of N-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine?
N-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine has a molecular weight of 210.36 g/mol, XLogP of 2.25, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine is sourced from PubChem (CID 60867302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).