5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine

C15H22N6 — CID 114528274

IUPAC5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine
SMILESCn1ccnc1CCN1CCN(c2ccc(N)nc2)CC1
InChIInChI=1S/C15H22N6/c1-19-7-5-17-15(19)4-6-20-8-10-21(11-9-20)13-2-3-14(16)18-12-13/h2-3,5,7,12H,4,6,8-11H2,1H3,(H2,16,18)
InChIKeyJJJVUYBVGNRCFS-UHFFFAOYSA-N
MW286.38 g/mol
LogP0.76
Rot. Bonds4

About 5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine

5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine (PubChem CID 114528274) has the molecular formula C15H22N6 and a molecular weight of 286.38 g/mol. Its IUPAC name is 5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine.

Molecular Properties

Compound Name5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine
PubChem CID114528274
Molecular FormulaC15H22N6
Molecular Weight286.38 g/mol
Exact Mass286.19
IUPAC Name5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine
SMILESCn1ccnc1CCN1CCN(c2ccc(N)nc2)CC1
InChIInChI=1S/C15H22N6/c1-19-7-5-17-15(19)4-6-20-8-10-21(11-9-20)13-2-3-14(16)18-12-13/h2-3,5,7,12H,4,6,8-11H2,1H3,(H2,16,18)
InChIKeyJJJVUYBVGNRCFS-UHFFFAOYSA-N
XLogP0.76
TPSA63.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-[4-[2-(1-methylpyrazol-4-yl)ethyl]piperazin-1-yl]pyridin-2-amine
CID 103003357
5-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyridin-2-amine
CID 60892816
5-[4-(2-methoxyethyl)piperazin-1-yl]pyridin-2-amine
CID 43461954
5-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]pyridin-2-amine
CID 63776250
6-[4-(6-amino-3-pyridinyl)piperazin-1-yl]hexan-1-ol
CID 107704033
4-(chloromethyl)-1-[2-(1-methylimidazol-2-yl)ethyl]piperidine
CID 114531735
5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]pyridin-2-amine
CID 62698240
5-[4-(1-ethylimidazol-2-yl)piperazin-1-yl]pyridin-2-amine
CID 62137504
5-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]pyridin-2-amine
CID 62127280
2-[4-(6-amino-3-pyridinyl)piperazin-1-yl]acetonitrile
CID 43461956
5-[4-(2-methylbutyl)piperazin-1-yl]pyridin-2-amine
CID 62104206
2-methyl-2-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]propan-1-amine
CID 114527386

Frequently Asked Questions

What is the IUPAC name of 5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine?
The IUPAC name of 5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine (CID 114528274) is 5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine.
What is the SMILES notation for 5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine?
The canonical SMILES for 5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine is Cn1ccnc1CCN1CCN(c2ccc(N)nc2)CC1.
What is the InChIKey of 5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine?
The InChIKey is JJJVUYBVGNRCFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N6/c1-19-7-5-17-15(19)4-6-20-8-10-21(11-9-20)13-2-3-14(16)18-12-13/h2-3,5,7,12H,4,6,8-11H2,1H3,(H2,16,18).
What are the key properties of 5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine?
5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine has a molecular weight of 286.38 g/mol, XLogP of 0.76, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[2-(1-methylimidazol-2-yl)ethyl]piperazin-1-yl]pyridin-2-amine is sourced from PubChem (CID 114528274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).