4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine

C17H30N4 — CID 61450858

IUPAC4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine
SMILESCCCN1CCC(CN)(N(CC)Cc2ccncc2)CC1
InChIInChI=1S/C17H30N4/c1-3-11-20-12-7-17(15-18,8-13-20)21(4-2)14-16-5-9-19-10-6-16/h5-6,9-10H,3-4,7-8,11-15,18H2,1-2H3
InChIKeyUAMUBYHIKKZJAV-UHFFFAOYSA-N
MW290.45 g/mol
LogP2.11
Rot. Bonds7

About 4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine

4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine (PubChem CID 61450858) has the molecular formula C17H30N4 and a molecular weight of 290.45 g/mol. Its IUPAC name is 4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine
PubChem CID61450858
Molecular FormulaC17H30N4
Molecular Weight290.45 g/mol
Exact Mass290.25
IUPAC Name4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine
SMILESCCCN1CCC(CN)(N(CC)Cc2ccncc2)CC1
InChIInChI=1S/C17H30N4/c1-3-11-20-12-7-17(15-18,8-13-20)21(4-2)14-16-5-9-19-10-6-16/h5-6,9-10H,3-4,7-8,11-15,18H2,1-2H3
InChIKeyUAMUBYHIKKZJAV-UHFFFAOYSA-N
XLogP2.11
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine?
The IUPAC name of 4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine (CID 61450858) is 4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine.
What is the SMILES notation for 4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine?
The canonical SMILES for 4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine is CCCN1CCC(CN)(N(CC)Cc2ccncc2)CC1.
What is the InChIKey of 4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine?
The InChIKey is UAMUBYHIKKZJAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-3-11-20-12-7-17(15-18,8-13-20)21(4-2)14-16-5-9-19-10-6-16/h5-6,9-10H,3-4,7-8,11-15,18H2,1-2H3.
What are the key properties of 4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine?
4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine has a molecular weight of 290.45 g/mol, XLogP of 2.11, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-ethyl-1-propyl-N-(pyridin-4-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 61450858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).