(Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine

C10H21N3 — CID 145230009

IUPAC(Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine
SMILESCCN1CCC(N/C=C(/C)N)CC1
InChIInChI=1S/C10H21N3/c1-3-13-6-4-10(5-7-13)12-8-9(2)11/h8,10,12H,3-7,11H2,1-2H3/b9-8-
InChIKeyCGVWRVUFQUALEH-HJWRWDBZSA-N
MW183.30 g/mol
LogP0.88
Rot. Bonds3

About (Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine

(Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine (PubChem CID 145230009) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is (Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine.

Molecular Properties

Compound Name(Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine
PubChem CID145230009
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Name(Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine
SMILESCCN1CCC(N/C=C(/C)N)CC1
InChIInChI=1S/C10H21N3/c1-3-13-6-4-10(5-7-13)12-8-9(2)11/h8,10,12H,3-7,11H2,1-2H3/b9-8-
InChIKeyCGVWRVUFQUALEH-HJWRWDBZSA-N
XLogP0.88
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine?
The IUPAC name of (Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine (CID 145230009) is (Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine.
What is the SMILES notation for (Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine?
The canonical SMILES for (Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine is CCN1CCC(N/C=C(/C)N)CC1.
What is the InChIKey of (Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine?
The InChIKey is CGVWRVUFQUALEH-HJWRWDBZSA-N. The full InChI is InChI=1S/C10H21N3/c1-3-13-6-4-10(5-7-13)12-8-9(2)11/h8,10,12H,3-7,11H2,1-2H3/b9-8-.
What are the key properties of (Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine?
(Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine has a molecular weight of 183.30 g/mol, XLogP of 0.88, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-N-(1-ethylpiperidin-4-yl)prop-1-ene-1,2-diamine is sourced from PubChem (CID 145230009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).