1-(5-hexylpyrimidin-2-yl)piperidin-4-amine

C15H26N4 — CID 103278601

IUPAC1-(5-hexylpyrimidin-2-yl)piperidin-4-amine
SMILESCCCCCCc1cnc(N2CCC(N)CC2)nc1
InChIInChI=1S/C15H26N4/c1-2-3-4-5-6-13-11-17-15(18-12-13)19-9-7-14(16)8-10-19/h11-12,14H,2-10,16H2,1H3
InChIKeyZBVRQDAUEIGEKY-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.53
Rot. Bonds6

About 1-(5-hexylpyrimidin-2-yl)piperidin-4-amine

1-(5-hexylpyrimidin-2-yl)piperidin-4-amine (PubChem CID 103278601) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-(5-hexylpyrimidin-2-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-(5-hexylpyrimidin-2-yl)piperidin-4-amine
PubChem CID103278601
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name1-(5-hexylpyrimidin-2-yl)piperidin-4-amine
SMILESCCCCCCc1cnc(N2CCC(N)CC2)nc1
InChIInChI=1S/C15H26N4/c1-2-3-4-5-6-13-11-17-15(18-12-13)19-9-7-14(16)8-10-19/h11-12,14H,2-10,16H2,1H3
InChIKeyZBVRQDAUEIGEKY-UHFFFAOYSA-N
XLogP2.53
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-fluoro-4-[3-[1-(5-pentylpyrimidin-2-yl)piperidin-4-yl]propoxy]aniline
CID 77106350
5-propyl-2-[4-(5-propylpyrimidin-2-yl)piperazin-1-yl]pyrimidine
CID 2811492
2-(4-tert-butylpiperidin-1-yl)-5-propylpyrimidine
CID 131998952
1-[2-(4-dodecylphenyl)ethyl]piperidin-4-amine
CID 72735441
5-(4,4-dimethylpentyl)-2-[4-(4,4-dimethylpentyl)piperidin-1-yl]pyrimidine
CID 176826711
1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine
CID 103278591
1-[5-[(4-fluorophenyl)methyl]pyrimidin-2-yl]piperidin-4-amine
CID 117224100
1-(5-propylpyrimidin-2-yl)piperidine-4-sulfonic acid
CID 151995167
[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]methanesulfonic acid
CID 86658031
2-piperidin-1-yl-5-propylpyrimidine
CID 123831355
4-chloro-5-fluoro-7-[1-(5-pentylpyrimidin-2-yl)piperidin-4-yl]pyrrolo[2,3-d]pyrimidine
CID 58057856
1-[5-[(3-methylphenyl)methyl]pyrimidin-2-yl]piperidin-4-amine
CID 117224089

Frequently Asked Questions

What is the IUPAC name of 1-(5-hexylpyrimidin-2-yl)piperidin-4-amine?
The IUPAC name of 1-(5-hexylpyrimidin-2-yl)piperidin-4-amine (CID 103278601) is 1-(5-hexylpyrimidin-2-yl)piperidin-4-amine.
What is the SMILES notation for 1-(5-hexylpyrimidin-2-yl)piperidin-4-amine?
The canonical SMILES for 1-(5-hexylpyrimidin-2-yl)piperidin-4-amine is CCCCCCc1cnc(N2CCC(N)CC2)nc1.
What is the InChIKey of 1-(5-hexylpyrimidin-2-yl)piperidin-4-amine?
The InChIKey is ZBVRQDAUEIGEKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-2-3-4-5-6-13-11-17-15(18-12-13)19-9-7-14(16)8-10-19/h11-12,14H,2-10,16H2,1H3.
What are the key properties of 1-(5-hexylpyrimidin-2-yl)piperidin-4-amine?
1-(5-hexylpyrimidin-2-yl)piperidin-4-amine has a molecular weight of 262.40 g/mol, XLogP of 2.53, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-hexylpyrimidin-2-yl)piperidin-4-amine is sourced from PubChem (CID 103278601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).